smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features COCC(=O)Nc1ncc([N+](=O)[O-])s1 4696170 QZIJIXYODVEVGG-UHFFFAOYSA-N 217.206 0.636 5 40 BCBB O=[N+]([O-])c1ccncc1S(=O)(=O)O 6088388 YRKGGPRZGXMSDE-UHFFFAOYSA-N 204.163 0.237 5 40 BCBB O=[N+]([O-])c1ccc(N[C@H]2CCNC2)nc1 52093921 IHQXNCLPRLYSSY-ZETCQYMHSA-N 208.221 0.764 5 40 BCBB in-vitro CNC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 97237946 UZTDXQJCRYBYKM-JTQLQIEISA-N 249.226 0.834 5 40 BCBB Cc1ccc([N+](=O)[O-])cc1P(=O)(O)O 199208276 PCCDEKSKEUBJRE-UHFFFAOYSA-N 217.117 0.706 5 40 BCBB COC(=O)C(C(=O)OC)c1ccc([N+](=O)[O-])o1 3369672 CHFZBXODFXBPGI-UHFFFAOYSA-N 243.171 0.617 5 40 BCBB O=C(c1nc[nH]c1[N+](=O)[O-])N1CCCCC1 4430826 KRZNXKVCPFAPKX-UHFFFAOYSA-N 224.220 0.944 5 40 BCBB COC(=O)[C@@H](N)Cc1cccc([N+](=O)[O-])c1 69553390 LXNVQGBXSRKLSX-VIFPVBQESA-N 224.216 0.638 5 40 BCBB O=[N+]([O-])c1cc([SH](=O)=O)ccc1F 64220271 HIUDJYLGLHDBGO-UHFFFAOYSA-N 205.166 0.704 5 40 BCBB Cn1c(=O)nc2n(C)c3ccccc3cc-2c1=O 1562941 AKVQGOMYPNAESS-UHFFFAOYSA-N 241.250 0.737 5 40 BCBB COC(=O)c1cccc(CO)c1[N+](=O)[O-] 642880885 VKGNRVZXJFABRC-UHFFFAOYSA-N 211.173 0.874 5 40 BCBB O=C1CC(Nc2ccc([N+](=O)[O-])cc2)=NN1 16428606 UMXNFNUFUVSSCU-UHFFFAOYSA-N 220.188 0.840 5 40 BCBB COC(=O)N(C)C(=O)c1[nH]cnc1[N+](=O)[O-] 5799797 GBTNPYOCMXXZEG-UHFFFAOYSA-N 228.164 0.156 5 40 BCBB NC(=O)[C@H]1CCCN1c1ccc([N+](=O)[O-])cn1 13014470 ZOIZIHPWRWZTPZ-MRVPVSSYSA-N 236.231 0.444 5 40 BCBB Cn1c(N)nc2ccc([N+](=O)[O-])cc2c1=O 274075 FKNXKKHUHWUIOL-UHFFFAOYSA-N 220.188 0.424 5 40 BCBB NNc1ccc([N+](=O)[O-])c(S(=O)(=O)O)c1 14988453 VIJBHIDEMTUNPV-UHFFFAOYSA-N 233.205 0.127 5 40 BCBB NC(=O)NCCNc1ccc([N+](=O)[O-])cc1 4741003 OJYWOOVHUFSZJP-UHFFFAOYSA-N 224.220 0.675 5 40 BCBB O=C(O)CNSc1ncccc1[N+](=O)[O-] 2568064 GLAQXAHJBCWHSL-UHFFFAOYSA-N 229.217 0.671 5 40 BCBB COC(=O)[C@@](C)(N)c1cccc([N+](=O)[O-])c1 95748089 NNURTFORWMBPDE-JTQLQIEISA-N 224.216 0.942 5 40 BCBB O=C1c2ccccc2C(=O)N1C[N+](=O)[O-] 100571269 YDDMBNGWLKLHOJ-UHFFFAOYSA-N 206.157 0.517 5 40 BCBB O=C(O)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1 19737086 FAZBOHQULMQUDK-UHFFFAOYSA-N 237.175 0.192 5 40 BCBB O=C(O)CS(=O)(=O)c1ccc([N+](=O)[O-])cc1 3250162 SICAMBKGKQLIOL-UHFFFAOYSA-N 245.212 0.453 5 40 BCBB N[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 50244251 YDHYUFZBCLPOHD-ZETCQYMHSA-N 208.221 0.527 5 40 BCBB CCOC(=O)c1c(O)c([N+](=O)[O-])c(C)[nH]c1=O 62714213 MSOMAFOTDFFXAP-UHFFFAOYSA-N 242.187 0.474 5 40 BCBB Nc1nc(N)nc(-c2ccccc2[N+](=O)[O-])n1 33068 KXKDEZZKBTYIFK-UHFFFAOYSA-N 232.203 0.611 5 40 BCBB COc1cc2c(cc1[N+](=O)[O-])no[n+]2[O-] 4211560 OZPJWLDBRHNAGG-UHFFFAOYSA-N 211.133 0.378 5 40 BCBB Cc1ccc(OCC(N)=O)c([N+](=O)[O-])c1 7442842 IYWTVJJSDROEHD-UHFFFAOYSA-N 210.189 0.767 5 40 BCBB CCONC(=O)c1ccc(N)c([N+](=O)[O-])c1 10635914 JWQOJIHVCGLMFK-UHFFFAOYSA-N 225.204 0.858 5 40 BCBB NS(=O)(=O)Cc1ccccc1[N+](=O)[O-] 38136986 SNCFSWRNEADGAI-UHFFFAOYSA-N 216.218 0.383 5 40 BCBB in-vitro Cc1nnnn1-c1cccc([N+](=O)[O-])c1 96191912 KOJZORORFNJKDA-UHFFFAOYSA-N 205.177 0.879 5 40 BCBB O=C(Cc1ccc([N+](=O)[O-])cc1)Nn1cnnc1 327227 JMBNLSGYSNJPLW-UHFFFAOYSA-N 247.214 0.499 5 40 BCBB CC(=O)N(C(C)=O)c1nn(C)c(C)c1[N+](=O)[O-] 4935740 YUMAKPQSMQWFPC-UHFFFAOYSA-N 240.219 0.536 5 40 BCBB Cc1c(CNc2[nH]ncc2[N+](=O)[O-])cnn1C 6527544 KAOIESOHQOCXRD-UHFFFAOYSA-N 236.235 0.972 5 40 BCBB Nc1ccc(N2CCOCC2=O)c([N+](=O)[O-])c1 199777523 IWAKDCIQECFICZ-UHFFFAOYSA-N 237.215 0.540 5 40 BCBB CCS(=O)(=O)c1c([N+](=O)[O-])ncn1C 987780 YWHNQFLXKVFHTO-UHFFFAOYSA-N 219.222 0.122 5 40 BCBB Cn1c(=O)n(C)c2nc([N+](=O)[O-])ccc21 2453882 JSMOQPGLEWVDLR-UHFFFAOYSA-N 208.177 0.180 5 40 BCBB COC(=O)[C@]1(c2ccc([N+](=O)[O-])cc2)C=CNN1 16125257 PAGXWYRZBXHOKK-LLVKDONJSA-N 249.226 0.585 5 40 BCBB CONC(=O)CCn1cc([N+](=O)[O-])nc1C 96999529 LOECVVWSGKQJFT-UHFFFAOYSA-N 228.208 0.167 5 40 BCBB NCc1ccc([C@@H]2CNC(=O)C2)c([N+](=O)[O-])c1 199775812 SJEVUPANEHLLNL-QMMMGPOBSA-N 235.243 0.657 5 40 BCBB O=[N+]([O-])c1cccc(F)c1C(CO)CO 40435299 CAMRYBIYYCRTJR-UHFFFAOYSA-N 215.180 0.802 5 40 BCBB CC(C)[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 48313180 DNSMOWKUWPPDIP-SSDOTTSWSA-N 241.251 0.347 5 40 BCBB COC(=O)[C@H]1[C@@H]2CC[C@H](C[C@H]1O)[N+]2(C)C 5015079 PRTGVCOFANEHJQ-RGOKHQFPSA-N 214.285 0.148 5 40 BCBB O=[N+]([O-])c1ccc(-c2n(O)cc[n+]2[O-])cc1 5676242 NBSRRHKMJCMHRR-UHFFFAOYSA-N 221.172 0.934 5 40 BCBB NC(=O)c1nc(-c2cccc([N+](=O)[O-])c2)oc1N 20607728 JUXXFMHJGODJBR-UHFFFAOYSA-N 248.198 0.931 5 40 BCBB O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC1 4686634 SKEDIKGKCAAKNT-UHFFFAOYSA-N 224.220 0.414 5 40 BCBB O=C(O)Cn1nc([N+](=O)[O-])cc1C(F)(F)F 35655542 ANEXKBCMNCRUKN-UHFFFAOYSA-N 239.109 0.895 5 40 BCBB CCOC(=O)Cn1cc([N+](=O)[O-])nc1C 343406 XMPREPGUGSKZIE-UHFFFAOYSA-N 213.193 0.663 5 40 BCBB O=c1[nH]c(Nc2ccccc2)c([N+](=O)[O-])c(=O)[nH]1 6575455 VNKWKVWBKYIBNE-UHFFFAOYSA-N 248.198 0.715 5 40 BCBB CC(C)(C)N1COC[C@](CO)([N+](=O)[O-])C1 19798255 XVHGCUHMCSFWJS-VIFPVBQESA-N 218.253 0.082 5 40 BCBB Nc1nc(N2CCOCC2)ccc1[N+](=O)[O-] 34416267 NDIFCWMHMGEUPK-UHFFFAOYSA-N 224.220 0.409 5 40 BCBB O=C(N=c1[nH]c2ccccc2[nH]1)[C@H]1C[C@H]1[N+](=O)[O-] 47238461 MDAXYSKDHYPNTG-IMTBSYHQSA-N 246.226 0.589 5 40 BCBB N=C(N)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 58112134 FBXUKOYTRFVPKY-QMMMGPOBSA-N 224.220 0.111 5 40 BCBB CCNC(=O)c1c([N+](=O)[O-])cnn1CC 72209494 UDDXRHIWSTXYPB-UHFFFAOYSA-N 212.209 0.561 5 40 BCBB CCN(CC)C(=O)c1c([N+](=O)[O-])cnn1C 87030 GHDAJKOKUHRTCE-UHFFFAOYSA-N 226.236 0.810 5 40 BCBB O=[N+]([O-])c1cccc2cn([N+](=O)[O-])nc12 5648962 XHSWVNQODRKABJ-UHFFFAOYSA-N 208.133 0.984 5 40 BCBB O=C(O)C[S@@](=O)c1ccc([N+](=O)[O-])cc1 34295093 QPJSCXVOHBMWNG-HNNXBMFYSA-N 229.213 0.787 5 40 BCBB in-vitro COCCCNC(=O)c1cc([N+](=O)[O-])c[nH]1 9453303 YDCMSMCNKKWKOY-UHFFFAOYSA-N 227.220 0.689 5 40 BCBB Cc1cc(NC(CO)CO)ccc1[N+](=O)[O-] 59540099 DYLAXNIUCHNYOK-UHFFFAOYSA-N 226.232 0.668 5 40 BCBB COC(=O)c1cn(CC(F)F)nc1[N+](=O)[O-] 685936524 CXOVHUVXFRYONN-UHFFFAOYSA-N 235.146 0.843 5 40 BCBB CCCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 12737500 UGUDRADGWOLUKS-UHFFFAOYSA-N 239.231 0.656 5 40 BCBB CCc1nc2ncnn2c(O)c1[N+](=O)[O-] 15082185 AEUHANDAUQPDNH-UHFFFAOYSA-N 209.165 0.301 5 40 BCBB CS(=O)(=O)Oc1ccc([N+](=O)[O-])cc1C=O 2564946 FKPRPRICPJNTKV-UHFFFAOYSA-N 245.212 0.746 5 40 BCBB O=C1CC[C@@H](CNc2ccc([N+](=O)[O-])cn2)N1 69930514 YUZJWICXZSNIED-ZETCQYMHSA-N 236.231 0.680 5 40 BCBB CN1CCc2nn3cc([N+](=O)[O-])cnc3c2C1 584906169 CYCKGEVPHDTZPZ-UHFFFAOYSA-N 233.231 0.625 5 40 BCBB O=[N+]([O-])c1cccnc1O[C@H]1CCNC1 51868439 IQYYIQLXFXNVHO-ZETCQYMHSA-N 209.205 0.731 5 40 BCBB O=C(Nc1ccc([N+](=O)[O-])cc1O)c1nc[nH]n1 4866360 IVFPYEWOFOCGET-UHFFFAOYSA-N 249.186 0.671 5 40 BCBB CN(C)CCOc1ccc([N+](=O)[O-])cn1 61997478 UDBRLIGKRUMVCN-UHFFFAOYSA-N 211.221 0.930 5 40 BCBB CCNC(=O)c1cc([N+](=O)[O-])c[nH]c1=O 12792456 FLSYBSDUKWOPDN-UHFFFAOYSA-N 211.177 0.033 5 40 BCBB Nc1nnc(OCc2ccccc2[N+](=O)[O-])[nH]1 225970366 PXJHUHDYVROENL-UHFFFAOYSA-N 235.203 0.874 5 40 BCBB CON(C)C(=O)c1cc([N+](=O)[O-])ccc1N 22048522 SCQCSIBASAKKBM-UHFFFAOYSA-N 225.204 0.810 5 40 BCBB in-vitro O=[N+]([O-])c1cccnc1N1CCS(=O)CC1 69538729 AHSZXMHKUAZPNP-UHFFFAOYSA-N 241.272 0.559 5 40 BCBB CC(=O)c1ccc(N2CC(O)C2)c([N+](=O)[O-])c1 57839075 MESFKOOLXGYEIR-UHFFFAOYSA-N 236.227 0.978 5 40 BCBB Cc1cc([N+](=O)[O-])cc2c(=O)oc(=O)[nH]c12 21982312 VLCKMQYUDYOWMA-UHFFFAOYSA-N 222.156 0.698 5 40 BCBB Cc1nn(C)c(N2CCOCC2)c1[N+](=O)[O-] 4323849 YHHWJTILXUVBAU-UHFFFAOYSA-N 226.236 0.473 5 40 BCBB Cn1cc(-c2nnc(N)s2)c([N+](=O)[O-])n1 144326256 HFOIFWLEPUPOFC-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB C[C@@H]1NNC(=O)[C@H]1c1ccc([N+](=O)[O-])cc1 1701997 UCVOGOBPJUGZJL-IMTBSYHQSA-N 221.216 0.701 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1O 59444437 IXHMHWIBCIYOAZ-UHFFFAOYSA-N 245.103 0.822 5 40 BCBB NCCC(=O)N1CCc2c1cccc2[N+](=O)[O-] 178132152 IHXMNKMICKRNGZ-UHFFFAOYSA-N 235.243 0.833 5 40 BCBB Cc1ccc([N+](=O)[O-])c(N2CC(C)(O)C2)n1 88036570 RRVVPEFXACLQSW-UHFFFAOYSA-N 223.232 0.869 5 40 BCBB O=C(O)c1nn(-c2ccccc2)nc1[N+](=O)[O-] 89261673 QCBIPVIUKUQRIZ-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB O=[N+]([O-])c1ccc([C@@H](O)Cn2cncn2)cc1 5570095 JBQIUUDXTWMFAA-JTQLQIEISA-N 234.215 0.920 5 40 BCBB O=C(O)c1c([N+](=O)[O-])cncc1[N+](=O)[O-] 2525003 WDAWZQCOUPDUDY-UHFFFAOYSA-N 213.105 0.596 5 40 BCBB COC(=O)c1ccc([C@@H](O)C[N+](=O)[O-])cc1 1396179 LNECTYJAMWFQHJ-VIFPVBQESA-N 225.200 0.783 5 40 BCBB CC(C)NC(=O)CNc1ncccc1[N+](=O)[O-] 23623207 PDQLLNQQHBCDGT-UHFFFAOYSA-N 238.247 0.926 5 40 BCBB COC(=O)CN[N+](C)(C)CCc1ccccc1 45221461 BAWPVGCUOBPYCI-UHFFFAOYSA-N 237.323 0.983 5 40 BCBB Cc1cc(=O)n(Cc2cnn(C)c2)cc1[N+](=O)[O-] 95416411 SPJHOCUWRYBBGV-UHFFFAOYSA-N 248.242 0.847 5 40 BCBB O=[N+]([O-])c1cc(F)ccc1N1CC(O)C1 57839119 AGBQOCQJTZEIFR-UHFFFAOYSA-N 212.180 0.915 5 40 BCBB CCCCc1nn(CCO)c(N)c1[N+](=O)[O-] 96527774 JYNBHDWAHKZPMT-UHFFFAOYSA-N 228.252 0.708 5 40 BCBB COc1cc([N+](=O)[O-])ccc1-n1nnnc1C 6505052 TWOUYTWMZPIMRY-UHFFFAOYSA-N 235.203 0.888 5 40 BCBB Cc1ccnc(NC(CO)CO)c1[N+](=O)[O-] 75877591 YTPQCRVRXCTWEH-UHFFFAOYSA-N 227.220 0.063 5 40 BCBB O=[N+]([O-])c1cc(-c2cc([N+](=O)[O-])[nH]n2)n[nH]1 5323041 ROYNNMFNYYKTHR-UHFFFAOYSA-N 224.136 0.616 5 40 BCBB CC(C)[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])n1 48313183 DNSMOWKUWPPDIP-ZETCQYMHSA-N 241.251 0.347 5 40 BCBB O=[N+]([O-])c1cccc(CNn2cnnc2)c1 7601157 WVLUDXYXPPUSBU-UHFFFAOYSA-N 219.204 0.930 5 40 BCBB COCCOC(=O)c1ccc(N)c([N+](=O)[O-])c1 18321741 USJSCCZETRWEQE-UHFFFAOYSA-N 240.215 0.980 5 40 BCBB CCC1([N+](=O)[O-])COP(=O)(O)OC1 1700854 QJEKCOUUPXSTBA-UHFFFAOYSA-N 211.110 0.559 5 40 BCBB COC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1 2635354 MLNYLEKKUHTEFP-YFKPBYRVSA-N 242.187 0.479 5 40 BCBB CON(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1 32779838 IQJZWFIMVDMPBZ-UHFFFAOYSA-N 226.188 0.934 5 40 BCBB O=C(O)[C@@H]1Cc2ccc([N+](=O)[O-])cc2CN1 34416164 DUNHNFQEXKIPND-VIFPVBQESA-N 222.200 0.694 5 40 BCBB in-vitro O=C(Cn1cc([N+](=O)[O-])ccc1=O)c1ccc[nH]1 22714818 LTXOBYUNRCQUJK-UHFFFAOYSA-N 247.210 0.968 5 40 BCBB O=C(O)COc1c([N+](=O)[O-])cccc1[N+](=O)[O-] 95094737 HEDPFFUEYDQJRQ-UHFFFAOYSA-N 242.143 0.966 5 40 BCBB CO[C@H]1[C@@H]2CC(=O)C[C@H]([C@H]1OC)[N+]2(C)C 5031467 HWLHUCCBZFCIKY-DTIDVZRVSA-N 214.285 0.207 5 40 BCBB NC1=NN(c2cccc([N+](=O)[O-])c2)NO1 17064397 ZYZGHXZUGIJWNN-UHFFFAOYSA-N 209.165 0.081 5 40 BCBB CC(C)C(=O)O[C@@H](CC(=O)O)C[N+](C)(C)C 12494296 LRCNOZRCYBNMEP-VIFPVBQESA-O 232.300 0.735 5 40 BCBB endogenous,in-man NS(=O)(=O)Nc1cccc([N+](=O)[O-])c1 12896225 XIZIOBPTGHLKKS-UHFFFAOYSA-N 217.206 0.210 5 40 BCBB O=[N+]([O-])c1ccc(OC[C@@H]2CNCCO2)cc1 83860201 UFWMAKQTLPXLGR-NSHDSACASA-N 238.243 0.962 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 12618194 CNPJNFNJIODHOF-UHFFFAOYSA-N 242.143 0.995 5 40 BCBB O=C1NC(=O)/C(=C/c2cccc([N+](=O)[O-])c2)N1 1637139 UXLLZDWZJYMJKG-YVMONPNESA-N 233.183 0.775 5 40 BCBB O=C(N=c1[nH]c2ccccc2[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-] 47238459 MDAXYSKDHYPNTG-HZGVNTEJSA-N 246.226 0.589 5 40 BCBB NC(=O)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 33434463 HADRPCVJNKYGGL-UHFFFAOYSA-N 237.215 0.799 5 40 BCBB COC(=O)[C@H](N)c1ccccc1[N+](=O)[O-] 95635309 URNHSHZABXHMQB-MRVPVSSYSA-N 210.189 0.768 5 40 BCBB in-vitro O=[N+]([O-])c1ccc2c(c1)OC[C@H](CO)O2 39276716 QSRIKCXVBZGOJP-ZETCQYMHSA-N 211.173 0.727 5 40 BCBB COc1nc(CC(C)=O)nc(OC)c1[N+](=O)[O-] 1314379 PPNKLVXLKPRYIR-UHFFFAOYSA-N 241.203 0.534 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1C(=O)O 4370068 MZWLPQOCYQOPMF-ZCFIWIBFSA-N 240.219 0.382 5 40 BCBB C[N+](C)(C)[C@]12CCC[C@H]1S(=O)(=O)C2 5052414 YDUTUONQGSGYEP-BDAKNGLRSA-N 204.315 0.412 5 40 BCBB CNC[C@@H](O)COc1ccc([N+](=O)[O-])cc1 19864669 VXKBHPFLIUMGNB-SECBINFHSA-N 226.232 0.554 5 40 BCBB in-vitro CN1C(N)=NC(=O)/C1=C/c1cccc([N+](=O)[O-])c1 19913444 DUPNCVIEZVEVNO-TWGQIWQCSA-N 246.226 0.722 5 40 BCBB O=C(O)c1cn2cccc([N+](=O)[O-])c2n1 3742148 NUZGPTNYBKNNMQ-UHFFFAOYSA-N 207.145 0.941 5 40 BCBB CN1CC[C@@H](Oc2cccnc2[N+](=O)[O-])C1=O 78757590 KCQIWSGSULMDBR-MRVPVSSYSA-N 237.215 0.599 5 40 BCBB O=[N+]([O-])c1nccn1C[C@@H](O)c1ccncc1 1508630 KUMYMICMJOLSMD-SECBINFHSA-N 234.215 0.920 5 40 BCBB COCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1 17321732 QRYFWYZMSSASHI-UHFFFAOYSA-N 240.215 0.677 5 40 BCBB Cc1cn(CCCC(=O)O)nc1[N+](=O)[O-] 35655695 VKSVRTXCDMUHEX-UHFFFAOYSA-N 213.193 0.965 5 40 BCBB O=c1[nH][nH]c(=O)c2nc3ccccc3nc12 8642295 GZMHVJBERKLXHN-UHFFFAOYSA-N 214.184 0.160 5 40 BCBB CC1(C)N/C(=C/[N+](=O)[O-])C(C)(C)N1O 8665357 ZHZPQQIGVLXKTM-AATRIKPKSA-N 201.226 0.914 5 40 BCBB Cn1c(C[N+](=O)[O-])nnc1C(F)(F)F 1385214 VWCNMZMAVIEAJB-UHFFFAOYSA-N 210.115 0.611 5 40 BCBB Cc1ccc(NCC(N)=O)cc1[N+](=O)[O-] 1604848 OSCGQFWLQWSLEX-UHFFFAOYSA-N 209.205 0.800 5 40 BCBB NS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1F 229695802 VYCRDOKTNMXMMC-UHFFFAOYSA-N 238.171 0.520 5 40 BCBB O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCO 1854833 UUKLRRWTNBUSIX-ZZXKWVIFSA-N 236.227 0.717 5 40 BCBB Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1CO 2529764 LGSMQOJOUHHVIW-UHFFFAOYSA-N 213.149 0.578 5 40 BCBB O=C(O)c1nn(-c2ccccn2)nc1[N+](=O)[O-] 89263469 MFBXBIPMNDLJDO-UHFFFAOYSA-N 235.159 0.269 5 40 BCBB C[C@@H](O)C(C)(C)Nc1ncc([N+](=O)[O-])c(N)n1 95447236 JHQAUJDEQXXWCM-RXMQYKEDSA-N 241.251 0.538 5 40 BCBB COC[C@@H](O)Cn1cc([N+](=O)[O-])nc1C 5116449 JXMRDOOWRDWKJG-ZETCQYMHSA-N 215.209 0.107 5 40 BCBB O=c1c(NO)c([N+](=O)[O-])cnn1-c1ccccc1 5809897 IJAOQXZBRMUTBZ-UHFFFAOYSA-N 248.198 0.942 5 40 BCBB O=C1OCCN1NCc1ccc([N+](=O)[O-])o1 1703125 MZWHEQPUCMIYKU-UHFFFAOYSA-N 227.176 0.645 5 40 BCBB O=C(O)Cn1cc([N+](=O)[O-])c(Cl)n1 19872697 MWHJIUSJRITIAP-UHFFFAOYSA-N 205.557 0.529 5 40 BCBB CC[C@H](C(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918816 IMYJABWLMOLFEA-SCSAIBSYSA-N 244.163 0.735 5 40 BCBB O=C(c1cc([N+](=O)[O-])[nH]n1)N1CCSCC1 9329774 QLJFSMVZZJAJOY-UHFFFAOYSA-N 242.260 0.507 5 40 BCBB O=C(O)C(=O)Nc1ncc([N+](=O)[O-])s1 20204732 QDDOOKFCVDDDDQ-UHFFFAOYSA-N 217.162 0.074 5 40 BCBB CC(C)n1nnnc1Cn1cc([N+](=O)[O-])cn1 95116712 VIADBDVZHQJZNI-UHFFFAOYSA-N 237.223 0.407 5 40 BCBB CC(C)n1nc([N+](=O)[O-])cc1CC(=O)O 72209562 QLFJXGXYPQPQQB-UHFFFAOYSA-N 213.193 0.999 5 40 BCBB O=CNc1cc(C(=O)O)cc([N+](=O)[O-])c1 5749192 CUXQUGJIWQQXNC-UHFFFAOYSA-N 210.145 0.861 5 40 BCBB O=[N+]([O-])c1ccc(OC[C@@H]2CCNC2)nc1 42774160 YVXQOMSEKJHQFO-MRVPVSSYSA-N 223.232 0.978 5 40 BCBB Nc1nc(N2CCCC2)ncc1[N+](=O)[O-] 48543823 AHSCQRMHTTVJGK-UHFFFAOYSA-N 209.209 0.567 5 40 BCBB Cc1ccnc(NCCNC(N)=O)c1[N+](=O)[O-] 96730891 WFLFTEDHRVSKGX-UHFFFAOYSA-N 239.235 0.378 5 40 BCBB Nc1nc([N+](=O)[O-])nn1-c1ccccc1 4558144 JKMKDMRBXCSPLE-UHFFFAOYSA-N 205.177 0.758 5 40 BCBB NC(=O)CCC(=O)Nc1cccc([N+](=O)[O-])c1 4670539 OKYSCWJNYWSZAK-UHFFFAOYSA-N 237.215 0.799 5 40 BCBB N[C](CC(=O)O)c1cccc([N+](=O)[O-])c1 1560408626 AOSWLNYXVRWEOX-UHFFFAOYSA-N 209.181 0.908 5 40 BCBB O=c1nc2[nH]c3cc(Cl)ccc3nc-2c(=O)[nH]1 5387530 KAKVPSJPXPQFIX-UHFFFAOYSA-N 248.629 0.765 5 40 BCBB NCOc1ccc(C(=O)O)cc1[N+](=O)[O-] 12359058 ZWKULSGOCVFVHI-UHFFFAOYSA-N 212.161 0.588 5 40 BCBB O=[N+]([O-])C1=C[C@@H]2NSN[C@H]2c2nsnc21 5382419 OXLXAZUXEVCWBI-ZAFYKAAXSA-N 243.273 0.335 5 40 BCBB CN(CC(N)=O)Cc1cc(F)ccc1[N+](=O)[O-] 40119079 QUHUPZHEWJPGPL-UHFFFAOYSA-N 241.222 0.651 5 40 BCBB C[N+](C)(C)[C@@]12CCC[C@H]1S(=O)(=O)C2 5052413 YDUTUONQGSGYEP-RKDXNWHRSA-N 204.315 0.412 5 40 BCBB CC1(C)N/C(=C\[N+](=O)[O-])C(C)(C)N1O 3101818 ZHZPQQIGVLXKTM-WAYWQWQTSA-N 201.226 0.914 5 40 BCBB NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 20666741 TWPIGLVTWJODLF-UHFFFAOYSA-N 232.199 0.879 5 40 BCBB CN(CCO)c1ccc(C(=O)O)cc1[N+](=O)[O-] 37853804 NZUMAQVTZREWLP-UHFFFAOYSA-N 240.215 0.722 5 40 BCBB CC1=NN(C)c2nc([N+](=O)[O-])nn2CC1 16513256 YRDDYDAEEANXJF-UHFFFAOYSA-N 210.197 0.402 5 40 BCBB Cc1c(C(=O)Nc2nnn[nH]2)cccc1[N+](=O)[O-] 6200713 UFEVZCMKYVVXTE-UHFFFAOYSA-N 248.202 0.669 5 40 BCBB O=[N+]([O-])c1ccc2cn([N+](=O)[O-])nc2c1 1572433 CZIDZUYPIHOUFI-UHFFFAOYSA-N 208.133 0.984 5 40 BCBB CN1CCN(c2ccc([N+](=O)[O-])c(N)n2)CC1 89064375 PDSWRHMCPBRBPJ-UHFFFAOYSA-N 237.263 0.324 5 40 BCBB CCS(=O)(=O)Cc1ncc([N+](=O)[O-])n1C 6244453 WOJWXHGCKLIUQL-UHFFFAOYSA-N 233.249 0.263 5 40 BCBB O=C1Cc2ccc([N+](=O)[O-])cc2C(=O)N1 95760979 ZMMZPBUDHFGBCQ-UHFFFAOYSA-N 206.157 0.407 5 40 BCBB NC(=O)c1cnn(-c2ccccc2[N+](=O)[O-])c1N 20283582 GZHBTVHPOBBMAU-UHFFFAOYSA-N 247.214 0.462 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=CN2 85223749 VXGQNQVXNSZYGA-UHFFFAOYSA-N 227.201 0.737 5 40 BCBB CNC(=S)/N=c1/sc([N+](=O)[O-])c(C)n1C 16952162 PTLGTXOVAXIOIN-VQHVLOKHSA-N 246.317 0.708 5 40 BCBB O=C(NCCO)c1ccc([N+](=O)[O-])c(O)c1 123254372 XUHNWRJHUMUVHQ-UHFFFAOYSA-N 226.188 0.023 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])ccc1NCCO 3886446 ZCXBRELULXFLOW-UHFFFAOYSA-N 226.188 0.697 5 40 BCBB COc1cc(-c2nnn[nH]2)cc([N+](=O)[O-])c1O 12418415 LLGWEMLOSOXAFB-UHFFFAOYSA-N 237.175 0.489 5 40 BCBB O=[N+]([O-])[C@@H]1CCN(Cc2ccccc2)[C@H]1O 13535499 GJSZKSQTYVGJMO-MNOVXSKESA-N 222.244 0.856 5 40 BCBB O=[N+]([O-])c1ccccc1CNCS(=O)(=O)O 1685593 SMJUPFMNYVJGAD-UHFFFAOYSA-N 246.244 0.530 5 40 BCBB NC(=O)C[C@@H](O)c1ccccc1[N+](=O)[O-] 4843961 OXRRMNGBCBMHEX-MRVPVSSYSA-N 210.189 0.504 5 40 BCBB O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)NC1CC1 5251545 HUESEZQRISPZJJ-UHFFFAOYSA-N 249.226 0.812 5 40 BCBB CN(CC(=O)O)c1ncccc1[N+](=O)[O-] 22223059 WKGQWRPZFLCPOO-UHFFFAOYSA-N 211.177 0.511 5 40 BCBB Cc1cc(C)c2[nH]c(=O)c(=O)[nH]c2c1[N+](=O)[O-] 408974152 VXVPUNCZJCAAPJ-UHFFFAOYSA-N 235.199 0.741 5 40 BCBB CC1([N+](=O)[O-])COP(=O)(NC2CC2)OC1 1686541 OEJBYBSMWWGVCL-UHFFFAOYSA-N 236.164 0.929 5 40 BCBB CC(C)(C)OC(=O)N1CC[C@@](O)(C[N+](=O)[O-])C1 307017440 SHPJPTZXXCPIIQ-JTQLQIEISA-N 246.263 0.635 5 40 BCBB CCCc1nn(CCO)c(N)c1[N+](=O)[O-] 96527772 XVTCYVLNYXZGRZ-UHFFFAOYSA-N 214.225 0.318 5 40 BCBB NC(=O)c1cc(Cl)ncc1[N+](=O)[O-] 95929123 DQVGPESWYIAYJV-UHFFFAOYSA-N 201.569 0.742 5 40 BCBB Cc1nn(CCS(C)(=O)=O)c(C)c1[N+](=O)[O-] 49002044 OUMPUYPMCGLBJZ-UHFFFAOYSA-N 247.276 0.453 5 40 BCBB O=C(O)C(=O)Nc1ccccc1[N+](=O)[O-] 6528737 IRLPIXPXNFUCRB-UHFFFAOYSA-N 210.145 0.618 5 40 BCBB Nc1nc(N)c([N+](=O)[O-])c(C(F)F)n1 217639363 SOSJJZKBPXUQIH-UHFFFAOYSA-N 205.124 0.487 5 40 BCBB COCCNc1ccc(C(N)=O)cc1[N+](=O)[O-] 5939407 SWDZGRDLRQCVOO-UHFFFAOYSA-N 239.231 0.752 5 40 BCBB O=[N+]([O-])C1([N+](=O)[O-])CCCc2nonc21 19228250 CMWAVDQYGJPEML-UHFFFAOYSA-N 214.137 0.112 5 40 BCBB COc1cc(C)nc(-n2cnc([N+](=O)[O-])n2)n1 96447881 CQFYYZLSPDICCC-UHFFFAOYSA-N 236.191 0.283 5 40 BCBB CCOC(=O)Cn1nc([N+](=O)[O-])nc1C 3094856 ZWEVGEBDFOTUKA-UHFFFAOYSA-N 214.181 0.058 5 40 BCBB Cn1cnc([N+](=O)[O-])c1Sc1n[nH]c(N)n1 6188101 LXSCOSMGNHQGDT-UHFFFAOYSA-N 241.236 0.180 5 40 BCBB O=[N+]([O-])c1ccccc1NCCNCCO 4358639 SENKLQCJXRHGAS-UHFFFAOYSA-N 225.248 0.589 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])c([N+](=O)[O-])cc1O 45957455 HPLYVSOWVIGQFU-UHFFFAOYSA-N 228.116 0.907 5 40 BCBB Cc1ccc(N2C=NNC(=O)C2)c([N+](=O)[O-])c1 59606975 RRVDIXGSBNYWQR-UHFFFAOYSA-N 234.215 0.783 5 40 BCBB C[N+](C)(C)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 18156291 ASNGCLKEZFFCDA-QWRGUYRKSA-N 239.339 0.868 5 40 BCBB Cc1ccc([N+](=O)[O-])c(S(N)(=O)=O)c1C 36948420 LHGXSPKBDOICJL-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB CC(=O)CCn1cnc([N+](=O)[O-])c1[N+](=O)[O-] 3944769 OJPJTSHEUGRTGD-UHFFFAOYSA-N 228.164 0.679 5 40 BCBB CCOC(=O)[C@@H](C)[C@@](C)(O)C[N+](=O)[O-] 5459590 JLKMVZMXSKOHLP-SVRRBLITSA-N 205.210 0.213 5 40 BCBB CNC(=O)c1cc([N+](=O)[O-])cnc1NC 19800907 PACYUVJDLGFPOB-UHFFFAOYSA-N 210.193 0.391 5 40 BCBB N[C@H](CC(=O)O)c1ccc([N+](=O)[O-])c(O)c1 44216316 HWEMRMVSMAWIRB-ZCFIWIBFSA-N 226.188 0.775 5 40 BCBB Cn1ncc([N+](=O)[O-])c1C(=O)n1cccn1 268818 AEQDMOCJLSMYLF-UHFFFAOYSA-N 221.176 0.213 5 40 BCBB O=c1nc2[nH]c3ccc(Cl)cc3nc-2c(=O)[nH]1 5606451 KBOXHAALUDKSPW-UHFFFAOYSA-N 248.629 0.765 5 40 BCBB CC[N+](C)(CC)[C@H]1CCS(=O)(=O)C1 6168607 UWWHYKPUCJQOSU-VIFPVBQESA-N 206.331 0.660 5 40 BCBB COC(=O)c1cnc(O)c([N+](=O)[O-])c1O 40564639 XFKYOFYOTZRQAW-UHFFFAOYSA-N 214.133 0.188 5 40 BCBB in-vitro COC(=O)NCCn1c([N+](=O)[O-])cnc1C 480301 MEBCWZZVDBDXJT-UHFFFAOYSA-N 228.208 0.456 5 40 BCBB NC(=S)NCc1ccc([N+](=O)[O-])cc1 3845889 MMUKXYWDBWHQBL-UHFFFAOYSA-N 211.246 0.928 5 40 BCBB biogenic O=C1Nc2c(cc([N+](=O)[O-])cc2[N+](=O)[O-])C1=O 4684320 LVEFROFFQJHJQW-UHFFFAOYSA-N 237.127 0.638 5 40 BCBB Nc1nnnn1-c1cccc([N+](=O)[O-])c1 16970470 YDTLOZIXLQSLQE-UHFFFAOYSA-N 206.165 0.153 5 40 BCBB O=C1C[C@@H](Oc2ccc([N+](=O)[O-])cc2)N1 34215163 FZKCDUYSEXXUPD-SECBINFHSA-N 208.173 0.820 5 40 BCBB in-vitro O=CNc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 1757426 IUHALJOKRIRTKP-UHFFFAOYSA-N 227.132 0.777 5 40 BCBB NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 4703165 OBHGEBFDECPNNZ-UHFFFAOYSA-N 209.161 0.019 5 40 BCBB COc1cc(C(N)=O)c(OC)c([N+](=O)[O-])c1 57340017 VFPYGSXYKTURTI-UHFFFAOYSA-N 226.188 0.711 5 40 BCBB C[N+]1([C@H]2CCS(=O)(=O)C2)CCCCC1 8299274 UMHRCNLJXONEHO-JTQLQIEISA-N 218.342 0.804 5 40 BCBB O=[N+]([O-])c1c(O)nc(O)nc1C(F)F 217638773 CDLAHBMRVWQIHC-UHFFFAOYSA-N 207.092 0.734 5 40 BCBB O=C(O)c1ncc([N+](=O)[O-])cc1[N+](=O)[O-] 98175530 UDAWNQMWUKVRRQ-UHFFFAOYSA-N 213.105 0.596 5 40 BCBB O=c1[nH]nc(CNc2ccc([N+](=O)[O-])cc2)[nH]1 95431095 FRJUKHBFYHFRHS-UHFFFAOYSA-N 235.203 0.618 5 40 BCBB O=[N+]([O-])c1ccc(OC[C@H]2CCNC2)nc1 42774164 YVXQOMSEKJHQFO-QMMMGPOBSA-N 223.232 0.978 5 40 BCBB CN(C)/C=C\c1nnc([N+](=O)[O-])s1 104142913 VMVKEXPTGFUUTD-ARJAWSKDSA-N 200.223 0.979 5 40 BCBB Cc1nc(Cn2cnc([N+](=O)[O-])c2)no1 26124026 BYCWVDCZBFZFAI-UHFFFAOYSA-N 209.165 0.531 5 40 BCBB COc1cc([N+](=O)[O-])c(S(=O)(=O)O)cc1N 4774351 QQSSZTDQUIRFNT-UHFFFAOYSA-N 248.216 0.432 5 40 BCBB NC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1 5513581 GMOVHLZDVIVTAW-UHFFFAOYSA-N 220.188 0.604 5 40 BCBB Nc1nc2ccc([N+](=O)[O-])cc2c(=O)[nH]1 5687396 AFQWWNVKKIMPGC-UHFFFAOYSA-N 206.161 0.414 5 40 BCBB O=[N+]([O-])c1cc(Cl)ccc1-[n+]1noc(O)n1 95116262 JITBFQBTIXQODB-UHFFFAOYSA-O 243.586 0.614 5 40 BCBB Cn1cnc([N+](=O)[O-])c1Sc1nnnn1C 1067379 KDJRUQCVYMLTGU-UHFFFAOYSA-N 241.236 0.003 5 40 BCBB O=c1[nH]cnc2cc3c(=O)[nH]cnc3cc12 5687333 KVUPNQMHDGVNNV-UHFFFAOYSA-N 214.184 0.160 5 40 BCBB biogenic COC(=O)c1cn([C@@H](C)C(=O)O)nc1[N+](=O)[O-] 408716948 TVGWMAWOSNBGGD-BYPYZUCNSA-N 243.175 0.224 5 40 BCBB CCOC(=O)c1nc(Cl)nc(N)c1[N+](=O)[O-] 5315926 QJPHEKZNWDRCBN-UHFFFAOYSA-N 246.610 0.797 5 40 BCBB C[C@H]1NNC(=O)[C@H]1c1ccc([N+](=O)[O-])cc1 1701998 UCVOGOBPJUGZJL-HZGVNTEJSA-N 221.216 0.701 5 40 BCBB Nc1ccc([N+](=O)[O-])cc1C(=O)N1CCCO1 195577303 WJQQWXDEKHHERJ-UHFFFAOYSA-N 237.215 0.955 5 40 BCBB CN1C(=O)N/C(=C/c2ccc([N+](=O)[O-])o2)C1=O 409193810 LWZKJCMENJFAAQ-GQCTYLIASA-N 237.171 0.710 5 40 BCBB COc1nn(CCN)c(C)c1[N+](=O)[O-] 20313042 ZQXIEDTZOPDTQD-UHFFFAOYSA-N 200.198 0.067 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])nn1CC(F)F 72209683 VDNHRCQEECDUFH-UHFFFAOYSA-N 221.119 0.755 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])cc2c1[nH][nH][n+]2=O 334157754 BVXHXSGRRYIKJU-UHFFFAOYSA-O 225.140 0.017 5 40 BCBB CNC(=O)c1cc([N+](=O)[O-])ccc1NC 4336606 SZTZQBZKKNUAMR-UHFFFAOYSA-N 209.205 0.996 5 40 BCBB CNC(=O)c1cc(C(=O)NC)cc([N+](=O)[O-])c1 5741580 RAGKIDSNQXYOEU-UHFFFAOYSA-N 237.215 0.314 5 40 BCBB O=C(O)CNC(=O)c1ccc(O)c([N+](=O)[O-])c1 12580807 MJVPTCPUVHAQES-UHFFFAOYSA-N 240.171 0.115 5 40 BCBB COc1cc([N+](=O)[O-])cc(-c2nnn[nH]2)c1O 13913985 QGSDWYYWVGDZDH-UHFFFAOYSA-N 237.175 0.489 5 40 BCBB Cc1nn(CN2CCOCC2)c(C)c1[N+](=O)[O-] 23623249 AFPPTKWCADWFFQ-UHFFFAOYSA-N 240.263 0.698 5 40 BCBB Cn1nnc(-c2cccc([N+](=O)[O-])c2)n1 34213689 NHHGYZUVVIVJSO-UHFFFAOYSA-N 205.177 0.785 5 40 BCBB Cc1ccc([N+](=O)[O-])c(P(=O)(O)O)c1 1870295 GMKUXZNZPRWWSH-UHFFFAOYSA-N 217.117 0.706 5 40 BCBB NNc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 5387429 JMGVADSLMBYDLQ-UHFFFAOYSA-N 238.163 0.665 5 40 BCBB O=[N+]([O-])C[C@@H](O)c1ccccc1[N+](=O)[O-] 34886986 VBINJEMMNGAHJO-MRVPVSSYSA-N 212.161 0.905 5 40 BCBB COc1c([N+](=O)[O-])cccc1S(N)(=O)=O 238421005 KRGIODSUNGRRSE-UHFFFAOYSA-N 232.217 0.251 5 40 BCBB NCCCn1cc(Cl)c([N+](=O)[O-])n1 2558406 DFMYPCVUOMXFMI-UHFFFAOYSA-N 204.617 0.794 5 40 BCBB O=[N+]([O-])c1ccccc1OC[C@@H]1CNCCO1 80745177 HTDGBNBKVQVFOZ-VIFPVBQESA-N 238.243 0.962 5 40 BCBB C[C@@H](Cn1nc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 1548918927 RSYCGEFXWMBSPU-BYPYZUCNSA-N 244.163 0.420 5 40 BCBB O=[N+]([O-])c1cccc(CS(=O)(=O)O)c1 96191894 FLKHMTSGHUOTCE-UHFFFAOYSA-N 217.202 0.983 5 40 BCBB N[C@@H](C(=O)O)[C@@H](O)c1ccc([N+](=O)[O-])cc1 518959 MDMLHLZJIBYSKV-SFYZADRCSA-N 226.188 0.040 5 40 BCBB biogenic O=C1NC(=O)/C(=C/c2cccc([N+](=O)[O-])c2O)N1 6240296 UINIBGVWABHMSR-XQRVVYSFSA-N 249.182 0.481 5 40 BCBB C[C@H](C(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918822 IWHXZHCGXBACRM-GSVOUGTGSA-N 230.136 0.345 5 40 BCBB Cc1nc([N+](=O)[O-])c2n1C[C@@H](O)CS2 346357 DFJODVNWQIWHEB-RXMQYKEDSA-N 215.234 0.566 5 40 BCBB Cc1nn(C)c(N2CC(CO)C2)c1[N+](=O)[O-] 84988480 SUFIHFRUCQJOOB-UHFFFAOYSA-N 226.236 0.065 5 40 BCBB CCNC(=O)CNc1cc(C)c([N+](=O)[O-])cn1 92026778 IZOPKDBPGSEFGG-UHFFFAOYSA-N 238.247 0.846 5 40 BCBB Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C(N)=O 2026820 YTUKZWSMRTXUPV-UHFFFAOYSA-N 225.160 0.910 5 40 BCBB COC[C@@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 56908474 VOYFGHFIASCJFX-RXMQYKEDSA-N 227.224 0.414 5 40 BCBB CC(C)N1CC[C@H](n2cc([N+](=O)[O-])cn2)C1=O 97047995 IVWYRQXWXYMIJR-VIFPVBQESA-N 238.247 0.973 5 40 BCBB CCN(Cc1ccc([N+](=O)[O-])cc1)C(=O)CN 79420838 KHARJCYQBSLQAY-UHFFFAOYSA-N 237.259 0.902 5 40 BCBB O=[N+]([O-])C[C@@]12O[C@@]3(O)[C@@H]4[C@@H]5[C@@H]([C@@H]6C[C@H]5[C@@H]3[C@@H]61)[C@@H]42 104023736 LOEIDFUDZVQDTE-CCRHOCROSA-N 235.239 0.108 5 40 BCBB CCO[C@@H]1NCCNc2c([N+](=O)[O-])ncn21 25179078 YFNLWJSMZSZSEA-MRVPVSSYSA-N 227.224 0.299 5 40 BCBB C[C@H]1C[N@]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 1857524264 IPKIIZQGCWXJFM-XVKPBYJWSA-N 242.256 0.988 5 40 BCBB CN1C(=O)C=C(Nc2ccc([N+](=O)[O-])cc2)C1=O 11613076 MSBVCOZQXZVUJL-UHFFFAOYSA-N 247.210 0.889 5 40 BCBB CO[C@@]1(C[N+](=O)[O-])OC(=O)c2ccccc21 77068 RSAZKHRUKRPGJB-JTQLQIEISA-N 223.184 0.933 5 40 BCBB C[N+](C)(C)C[C@H]1CC[C@H](C[N+](C)(C)C)C1=O 1617304 VYANHMVPRSBSJH-VXGBXAGGSA-N 228.380 0.994 5 40 BCBB N[C@H](C(=O)O)[C@H](O)c1ccc([N+](=O)[O-])cc1 518958 MDMLHLZJIBYSKV-JGVFFNPUSA-N 226.188 0.040 5 40 BCBB biogenic O=c1c([N+](=O)[O-])c[nH]c2nc(C(F)(F)F)nn12 1295899 GTANJGLBIXKKEK-UHFFFAOYSA-N 249.108 0.345 5 40 BCBB CCS(=O)(=O)Cc1c([N+](=O)[O-])cnn1C 96532751 IGLKEJIEDYKQRY-UHFFFAOYSA-N 233.249 0.263 5 40 BCBB CCOC(=O)[C@H](C)[C@](C)(O)C[N+](=O)[O-] 5460058 JLKMVZMXSKOHLP-POYBYMJQSA-N 205.210 0.213 5 40 BCBB CC(=O)Nc1cc(N)c([N+](=O)[O-])c(C(=O)O)c1 14981989 MUMKZTDIVDHANZ-UHFFFAOYSA-N 239.187 0.834 5 40 BCBB O=Cc1cn(-c2ccccc2[N+](=O)[O-])nn1 85272301 SLGBSJQSUCKFKH-UHFFFAOYSA-N 218.172 0.988 5 40 BCBB O=[N+]([O-])[C@H]1CCN(Cc2ccccc2)[C@H]1O 13535491 GJSZKSQTYVGJMO-QWRGUYRKSA-N 222.244 0.856 5 40 BCBB NC(=O)NOCc1cccc([N+](=O)[O-])c1 1714503 MGSHXJQWMVRTIE-UHFFFAOYSA-N 211.177 0.695 5 40 BCBB CN(Cc1cccc([N+](=O)[O-])c1)C(=O)CN 37810930 TYZVSXGHFFNZSQ-UHFFFAOYSA-N 223.232 0.512 5 40 BCBB O=C(O)CCSc1[nH]cnc1[N+](=O)[O-] 1757336 SFUHBLOUYUAXJS-UHFFFAOYSA-N 217.206 0.885 5 40 BCBB C[C@@H](CCO)[N+]1(C)CC[N+](C)(C)CC1 272398 RXQJUVZQCIHWEF-NSHDSACASA-N 202.342 0.294 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])ccc1-n1cnnn1 21968578 IFMXTXSCYARSKJ-UHFFFAOYSA-N 235.159 0.269 5 40 BCBB COC[C@H](O)CNc1ncc([N+](=O)[O-])cc1C 71271788 LWDNXZXRCQUXQH-SECBINFHSA-N 241.247 0.717 5 40 BCBB CS(=O)(=O)Oc1ccccc1[N+](=O)[O-] 2061771 VLXIMKLSBONXJY-UHFFFAOYSA-N 217.202 0.933 5 40 BCBB NC(=O)c1cccc2ncc([N+](=O)[O-])n12 89201833 OUSLOEFPQVPTHE-UHFFFAOYSA-N 206.161 0.341 5 40 BCBB O=c1[nH]c2ccccc2c(=O)n2nccc12 129463 SCNRKXGSZLWZMY-UHFFFAOYSA-N 213.196 0.536 5 40 BCBB Cc1nn2cc(C=O)cnc2c1[N+](=O)[O-] 370716 JEHNZZDKZWTXJO-UHFFFAOYSA-N 206.161 0.758 5 40 BCBB O=C1CN(C(=O)c2ccc([N+](=O)[O-])cc2)CCN1 17818400 KMQGFHIJWMYRCN-UHFFFAOYSA-N 249.226 0.167 5 40 BCBB NC(=O)c1cn(-c2ccccc2[N+](=O)[O-])cn1 95094107 LDESNMCURKHACG-UHFFFAOYSA-N 232.199 0.879 5 40 BCBB CCOC(=O)[C@@H](CC)[C@](C)(O)C[N+](=O)[O-] 5468466 POFPSRKAOLOFKX-VXNVDRBHSA-N 219.237 0.603 5 40 BCBB COC(=O)c1ccn(-c2ncccc2[N+](=O)[O-])n1 12398968 AHJBGEOWORHMRK-UHFFFAOYSA-N 248.198 0.962 5 40 BCBB CN(CCO)C(=O)c1ccc([N+](=O)[O-])cc1 1601621 BJXIZQZLLSFKRL-UHFFFAOYSA-N 224.216 0.659 5 40 BCBB Nc1ncnc(N2CCCC2)c1[N+](=O)[O-] 3912627 NMCIFFZGCBQSSF-UHFFFAOYSA-N 209.209 0.567 5 40 BCBB O=C(O)c1cnn(Cn2ccc([N+](=O)[O-])n2)c1 12357805 GMTSGGZAVSKGHD-UHFFFAOYSA-N 237.175 0.192 5 40 BCBB C[C@H]1C(=O)NCCN1Cc1ccc([N+](=O)[O-])cc1 60377283 OQIXYIQJUDBUIU-VIFPVBQESA-N 249.270 0.915 5 40 BCBB COc1ccc([N+](=O)[O-])c(OCC(N)=O)c1 139168164 ZXZAURQUHYXYHW-UHFFFAOYSA-N 226.188 0.468 5 40 BCBB C[N+]1(c2nc(N)nc3nc[nH]c23)CCCC1 22048888 PRCLSRPHADVGIE-UHFFFAOYSA-N 219.272 0.666 5 40 BCBB in-vitro Nc1nc(N2CCCCC2)ncc1[N+](=O)[O-] 48543699 XRXZUQMVCINTSC-UHFFFAOYSA-N 223.236 0.957 5 40 BCBB Cc1cc([N+](=O)[O-])cc(C)c1S(N)(=O)=O 82087294 UTSRNARAWGIFIB-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB O=[N+]([O-])c1cn(CC(F)F)nc1[N+](=O)[O-] 238850440 BPSXISVIBAVUNV-UHFFFAOYSA-N 222.107 0.965 5 40 BCBB O=C1NC(=O)[C@]2(Cc3ccc([N+](=O)[O-])cc3C2)N1 39291583 MTLBOQSPYBYFJF-LLVKDONJSA-N 247.210 0.272 5 40 BCBB C[n+]1ncc(N)c2cc([N+](=O)[O-])ccc21 4795538 WZYWMCPNOWKGJN-UHFFFAOYSA-O 205.197 0.550 5 40 BCBB O=c1[nH][nH]c(=O)c2cc([N+](=O)[O-])ccc12 8580635 XQFIOLKLHNOFCA-UHFFFAOYSA-N 207.145 0.125 5 40 BCBB in-vitro O=C1NCCN1c1ncc([N+](=O)[O-])s1 3875416 RDXLYGJSWZYTFJ-UHFFFAOYSA-N 214.206 0.581 5 40 BCBB in-man O=[N+]([O-])c1ccc(Cc2nnn[nH]2)cc1 15453132 IFCSVRFWBHAENG-UHFFFAOYSA-N 205.177 0.699 5 40 BCBB in-vitro COCCOC(=O)c1cc([N+](=O)[O-])ccc1N 11393448 XDZDEFZIJHXJSX-UHFFFAOYSA-N 240.215 0.980 5 40 BCBB O=[N+]([O-])c1cc(CO)ccc1N1CCOCC1 4272129 PQEXFMTYWKFNQQ-UHFFFAOYSA-N 238.243 0.924 5 40 BCBB O=[N+]([O-])c1cccnc1O[C@@H]1CCNC1 51868437 IQYYIQLXFXNVHO-SSDOTTSWSA-N 209.205 0.731 5 40 BCBB CN1C(N)=NC(=O)/C1=C\c1cccc([N+](=O)[O-])c1 6169372 DUPNCVIEZVEVNO-RMKNXTFCSA-N 246.226 0.722 5 40 BCBB COC(=O)c1cnn(-c2ccc([N+](=O)[O-])cn2)c1 12398226 OBROTWRXQBOWTM-UHFFFAOYSA-N 248.198 0.962 5 40 BCBB O=COC(OC=O)c1ccccc1[N+](=O)[O-] 30836127 DIBUVCJQIJAGEK-UHFFFAOYSA-N 225.156 0.939 5 40 BCBB CN(N)c1ccc([N+](=O)[O-])c2c1c(N)nn2C 4277475 VGYKVVJMRMTEOC-UHFFFAOYSA-N 236.235 0.374 5 40 BCBB NNc1ccc2nc3ccccc3c(=O)n2n1 1465288 KQPNIYZQKNBDIE-UHFFFAOYSA-N 227.227 0.528 5 40 BCBB COc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C 203110 KWRYGPCQCPMEFS-UHFFFAOYSA-N 237.215 0.794 5 40 BCBB NC(=O)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 69741270 CITUFVKLTISXSC-UHFFFAOYSA-N 246.226 0.944 5 40 BCBB NS(=O)(=O)Cc1c(F)cccc1[N+](=O)[O-] 96529979 QRXXCSUDUMZPQF-UHFFFAOYSA-N 234.208 0.522 5 40 BCBB O=C(O)[C@H]1CNC[C@@H]1c1ccc([N+](=O)[O-])cc1 54965237 UHORFZASTCWSKS-ZJUUUORDSA-N 236.227 0.982 5 40 BCBB COCCNc1ncnc(N)c1[N+](=O)[O-] 3912485 QXSYMNCINYOCLI-UHFFFAOYSA-N 213.197 0.025 5 40 BCBB CC(=O)NC1=N[C@](C)([N+](=O)[O-])CS1 4727088 IWIDYCJWZVHUCE-ZCFIWIBFSA-N 203.223 0.218 5 40 BCBB O=C(O)Cc1cc2c(cc1[N+](=O)[O-])OCO2 1674639 ZHTQCIXLJCGBSL-UHFFFAOYSA-N 225.156 0.951 5 40 BCBB O=C1CS(=O)(=O)c2ccc([N+](=O)[O-])cc21 339651 FRVJPCXMCXAHGL-UHFFFAOYSA-N 227.197 0.565 5 40 BCBB O=c1[nH]c(O)nc2cc(F)c([N+](=O)[O-])cc12 26899391 LXSGVXDLSKJWDH-UHFFFAOYSA-N 225.135 0.676 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c(N)cc1O 34186557 JALSFXCPHVLKBQ-UHFFFAOYSA-N 212.161 0.669 5 40 BCBB CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 32627999 LVLMPGIBDDHXIK-UHFFFAOYSA-N 235.199 0.993 5 40 BCBB Cn1c(=O)ccc2c1nc1ccccc1[n+]2[O-] 1587130 HMVMAEFIELIWRE-UHFFFAOYSA-N 227.223 0.720 5 40 BCBB COc1cc([N+](=O)[O-])cc(C(N)=O)c1OC 57339929 CEJBVFQVBDHLES-UHFFFAOYSA-N 226.188 0.711 5 40 BCBB O=[N+]([O-])c1cccnc1N1CC[C@H](O)C1 61707346 FUXKOUYCQVMHTN-ZETCQYMHSA-N 209.205 0.561 5 40 BCBB COC(=O)C(=O)c1ccc([N+](=O)[O-])cc1 38293348 KCJNETLTNKSVGA-UHFFFAOYSA-N 209.157 0.951 5 40 BCBB CS(=O)(=O)Cc1ccc([N+](=O)[O-])o1 6298678 ONXLQCUJQCOECR-UHFFFAOYSA-N 205.191 0.732 5 40 BCBB CC(=O)NCCNc1ncccc1[N+](=O)[O-] 22225844 MJTNPJYUMXZPNB-UHFFFAOYSA-N 224.220 0.538 5 40 BCBB CC(=O)O[C](CC(=O)O)C[N+](C)(C)C 1560407703 VZPMFHLEMPGPHJ-UHFFFAOYSA-O 203.238 0.262 5 40 BCBB COC(=O)[C@](C)(N)c1cccc([N+](=O)[O-])c1 95758278 NNURTFORWMBPDE-SNVBAGLBSA-N 224.216 0.942 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])c2[nH]nnc2c1 19907467 CICJYYXCHDFAHJ-UHFFFAOYSA-N 208.133 0.564 5 40 BCBB in-vitro CC(=O)CCn1cc([N+](=O)[O-])nc1[N+](=O)[O-] 4587444 DZJIVIZOLMQCAK-UHFFFAOYSA-N 228.164 0.679 5 40 BCBB CCOc1nn(CCC(=O)OC)cc1[N+](=O)[O-] 253400859 MBNFAUAPTYSEKG-UHFFFAOYSA-N 243.219 0.753 5 40 BCBB Cc1ncc([N+](=O)[O-])n1Cc1nncs1 13207415 DXLSOVLZWVCUTA-UHFFFAOYSA-N 225.233 1.000 5 40 BCBB CNC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1 5250789 NZOXWECYJDNSRB-UHFFFAOYSA-N 223.188 0.279 5 40 BCBB Cc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1C 12970898 MLIVZEQFCUAXSF-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB Cc1ccc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1C 32933165 CQJFPTGXTSJWNO-NXEZZACHSA-N 237.259 0.615 5 40 BCBB O=[N+]([O-])c1cccnc1N1CC[C@@H](O)C1 61707347 FUXKOUYCQVMHTN-SSDOTTSWSA-N 209.205 0.561 5 40 BCBB O=C(NO[C@@H]1CCCCO1)[C@@H]1C[C@H]1[N+](=O)[O-] 106531412 CDOUWDMTGNDIRM-BWZBUEFSSA-N 230.220 0.226 5 40 BCBB CC(C)(C)OC(=O)N1CC[C@](O)(C[N+](=O)[O-])C1 307017441 SHPJPTZXXCPIIQ-SNVBAGLBSA-N 246.263 0.635 5 40 BCBB CCOc1nn(CCCN)cc1[N+](=O)[O-] 12357750 WDVIXHUEYIPXCL-UHFFFAOYSA-N 214.225 0.539 5 40 BCBB Cc1c(CS(N)(=O)=O)cccc1[N+](=O)[O-] 35649583 BJNRXZWFHZZIIC-UHFFFAOYSA-N 230.245 0.692 5 40 BCBB CCOC(=O)CC1(C[N+](=O)[O-])COC1 45028277 ADFBBDNXRMDBHN-UHFFFAOYSA-N 203.194 0.233 5 40 BCBB in-vitro CCN/C=C/c1c[n+]([O-])ccc1[N+](=O)[O-] 100032832 OPMCYXXLPDNWBT-HWKANZROSA-N 209.205 0.808 5 40 BCBB Cn1nnc2c([N+](=O)[O-])cc(C(=O)O)cc21 218257915 RISXMNWDBZCVAJ-UHFFFAOYSA-N 222.160 0.575 5 40 BCBB NCC(=O)NCc1ccc([N+](=O)[O-])cc1 37668450 FPKAYPDWPLXRKZ-UHFFFAOYSA-N 209.205 0.170 5 40 BCBB C[N+](C)(C)C[C@@H]1CC[C@H](C[N+](C)(C)C)C1=O 16953060 VYANHMVPRSBSJH-TXEJJXNPSA-N 228.380 0.994 5 40 BCBB Nc1nc(-c2ccc([N+](=O)[O-])cc2)cc(=O)[nH]1 17013792 VDRSFDCFYUIRKG-UHFFFAOYSA-N 232.199 0.927 5 40 BCBB NC(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)c1 63458 OJAOUDISSHMHFA-UHFFFAOYSA-N 246.226 0.944 5 40 BCBB O=[N+]([O-])c1cccc(-c2n(O)cc[n+]2[O-])c1 5671450 XPEIUKNAWOSJFT-UHFFFAOYSA-N 221.172 0.934 5 40 BCBB CN1C(=O)COc2cc([N+](=O)[O-])ccc21 11691863 ZBHRAYSDUNQXKV-UHFFFAOYSA-N 208.173 0.950 5 40 BCBB Cc1nn2nnc3ccccc3c2nc1=O 89499479 SLKVKXUGHHSMSO-UHFFFAOYSA-N 213.200 0.341 5 40 BCBB Nc1nc(=O)[nH]cc1-c1ccc([N+](=O)[O-])cc1 1577773 XQZLTKHEIQNSHO-UHFFFAOYSA-N 232.199 0.927 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)N[C@@H](O)[C@@H](O)N2 5955891 UECLGMYJNJOYES-SFYZADRCSA-N 211.177 0.069 5 40 BCBB CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1 25199766 JCMYDLHZIRZJFG-UHFFFAOYSA-N 237.215 0.071 5 40 BCBB O=C(O)[C@@H]1CNC[C@H]1c1ccc([N+](=O)[O-])cc1 4241637 UHORFZASTCWSKS-VHSXEESVSA-N 236.227 0.982 5 40 BCBB N=C(N)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 58112130 FBXUKOYTRFVPKY-MRVPVSSYSA-N 224.220 0.111 5 40 BCBB O=C(O)c1cn2ccc([N+](=O)[O-])cc2n1 238669967 WKIQQPQWRJEVJZ-UHFFFAOYSA-N 207.145 0.941 5 40 BCBB O=[N+]([O-])c1cc(C2=NCCN2)cc([N+](=O)[O-])c1 4181913 QKCBYMGVNLQDPP-UHFFFAOYSA-N 236.187 0.853 5 40 BCBB NNc1ccc([N+](=O)[O-])cc1-c1nnn[nH]1 33924292 RJGHMJJKXGIYMA-UHFFFAOYSA-N 221.180 0.061 5 40 BCBB Nc1nc(N)nc(-c2cccc([N+](=O)[O-])c2)n1 1513925 VPHQFMMMDMEBFG-UHFFFAOYSA-N 232.203 0.611 5 40 BCBB O=[N+]([O-])c1cccc(CNc2nnn[nH]2)c1 22109487 HDGQIJORCRRQJB-UHFFFAOYSA-N 220.192 0.720 5 40 BCBB N[C@H]1CC(=O)N(c2ccccc2[N+](=O)[O-])C1=O 20790568 YZQCBASAMUPCDK-LURJTMIESA-N 235.199 0.185 5 40 BCBB Cc1c([N+](=O)[O-])cccc1S(N)(=O)=O 21013934 LHKYXFQCFKOOCS-UHFFFAOYSA-N 216.218 0.551 5 40 BCBB in-vitro NS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-] 48369962 LRGRKTFEHNKVPC-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB Cc1ccc(-n2cnnn2)cc1[N+](=O)[O-] 289540 XPCKFADKYAARHJ-UHFFFAOYSA-N 205.177 0.879 5 40 BCBB Cc1ccc(OCC(N)=O)c([N+](=O)[O-])n1 12644330 LPMVSVCGJBWHBN-UHFFFAOYSA-N 211.177 0.162 5 40 BCBB O=C(NC1CCSCC1)[C@@H]1C[C@@H]1[N+](=O)[O-] 58421731 CLMRYXYJZAZDJN-SFYZADRCSA-N 230.289 0.663 5 40 BCBB O=C(O)COc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 38313737 CSEMUAZJBOOLFQ-UHFFFAOYSA-N 242.143 0.966 5 40 BCBB NC(=O)c1c(F)cc([N+](=O)[O-])cc1[N+](=O)[O-] 3669496 KDTIDOUVKSLCTQ-UHFFFAOYSA-N 229.123 0.741 5 40 BCBB Cc1nnnn1Cc1ccc([N+](=O)[O-])cc1 59488306 UIJHDOKXWIVDCS-UHFFFAOYSA-N 219.204 0.938 5 40 BCBB COC(=O)CSCn1nc([N+](=O)[O-])cc1C 12395721 KSBQGRNBTXUWIB-UHFFFAOYSA-N 245.260 0.963 5 40 BCBB NS(=O)(=O)c1cccc([N+](=O)[O-])c1Cl 114002635 YSJPYCOLWBGBRG-UHFFFAOYSA-N 236.636 0.896 5 40 BCBB O=C(O[C@@H]1CCOC1=O)c1ccc([N+](=O)[O-])o1 3329289 YFXHFWKTKINLHY-ZCFIWIBFSA-N 241.155 0.660 5 40 BCBB Nc1ccc(OCC(=O)O)cc1[N+](=O)[O-] 198791686 VNXLOYFEKYNCSA-UHFFFAOYSA-N 212.161 0.640 5 40 BCBB O=c1nc2[nH]c3ccccc3[nH]c-2nc1=O 5594062 LESSCAUCDFQASR-UHFFFAOYSA-N 214.184 0.111 5 40 BCBB Cc1c(N)cc(C(=O)O)c([N+](=O)[O-])c1N 14982568 QYUHICZFIDZFOL-UHFFFAOYSA-N 211.177 0.766 5 40 BCBB O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCCC1 124467 AGGSYJVTLPKCFW-UHFFFAOYSA-N 224.220 0.944 5 40 BCBB O=C(NCCO)c1ccc(Cl)c([N+](=O)[O-])c1 37975426 PMMVJUABCIHELF-UHFFFAOYSA-N 244.634 0.970 5 40 BCBB O=C(c1cc([N+](=O)[O-])c[nH]1)N1CC[C@@H](O)C1 61704160 HKOHXJOXWNIVMX-SSDOTTSWSA-N 225.204 0.130 5 40 BCBB NC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 97081700 WVMMSCPWQIKBAU-SECBINFHSA-N 235.199 0.573 5 40 BCBB C[N+]12CCC(CC1)[C@](C#N)(N1CCOCC1)C2 178973 CYCZWAYOSRRYDY-MFOWVQHXSA-N 236.339 0.451 5 40 BCBB Cc1c([N+](=O)[O-])c(C(=O)NC(C)C)nn1C 376073 FLRUFJFXOMNUFF-UHFFFAOYSA-N 226.236 0.775 5 40 BCBB CNc1c([N+](=O)[O-])nn(-c2cccc(C)c2)[n+]1[O-] 4922673 FDTNMAJGGLYQPZ-UHFFFAOYSA-N 249.230 0.764 5 40 BCBB NNc1ccc([N+](=O)[O-])c2[nH]nc(N)c12 4277474 GEGOYVYMYUGKLG-UHFFFAOYSA-N 208.181 0.339 5 40 BCBB CN1C[N+](C)(CCO)CSC1=S 1665408 USAPWKWZEFYTNN-UHFFFAOYSA-N 207.344 0.304 5 40 BCBB Cc1cc2[nH]c(=O)c(=O)[nH]c2cc1[N+](=O)[O-] 32099378 VREQQHQFADBYHT-UHFFFAOYSA-N 221.172 0.433 5 40 BCBB O=C(O)c1cc(Cn2cc([N+](=O)[O-])cn2)on1 26545233 SSASCVODXGMETH-UHFFFAOYSA-N 238.159 0.526 5 40 BCBB CCOC(=O)c1ccnc(O)c1[N+](=O)[O-] 396104183 ZGVFJKIMFAEXTR-UHFFFAOYSA-N 212.161 0.872 5 40 BCBB O=C(O)c1cn(-c2cccc([N+](=O)[O-])c2)nn1 37291072 YHUTUVUHTBFLBF-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB O=C(NCc1ccccc1[N+](=O)[O-])c1cnn[nH]1 49250578 JAEPZKPRNIXYGS-UHFFFAOYSA-N 247.214 0.643 5 40 BCBB Cc1cc(N)c([N+](=O)[O-])cc1NCCO 77032113 LGZSBRSLVPLNTM-UHFFFAOYSA-N 211.221 0.890 5 40 BCBB COc1ccc([N+](=O)[O-])cc1CC(N)=O 685937248 DMZYRANXOJVNEK-UHFFFAOYSA-N 210.189 0.631 5 40 BCBB CC(C)CONc1ncc([N+](=O)[O-])c(N)n1 95452435 XXEASELEMZJPSI-UHFFFAOYSA-N 227.224 0.967 5 40 BCBB Cc1ccc(P(=O)(O)O)c([N+](=O)[O-])c1 1725592 HIGWXQMNWCLHJA-UHFFFAOYSA-N 217.117 0.706 5 40 BCBB NCCCn1cc(-n2cc([N+](=O)[O-])cn2)cn1 685936614 KWXOEMZALNKNMZ-UHFFFAOYSA-N 236.235 0.326 5 40 BCBB CCOC(=O)Cn1cc([N+](=O)[O-])c(C)n1 96029584 ARXZSHOLMCHJKZ-UHFFFAOYSA-N 213.193 0.663 5 40 BCBB Cn1nc([N+](=O)[O-])c(Cl)c1C(=O)O 20313869 ZIBFUEQMNQITNU-UHFFFAOYSA-N 205.557 0.680 5 40 BCBB O=C(NO[C@@H]1CCCCO1)[C@H]1C[C@@H]1[N+](=O)[O-] 58423591 CDOUWDMTGNDIRM-BIIVOSGPSA-N 230.220 0.226 5 40 BCBB CCc1noc(Cn2ncc([N+](=O)[O-])c2N)n1 95416389 BFMPZFNTNHZKNR-UHFFFAOYSA-N 238.207 0.367 5 40 BCBB Cc1nc2sccn2c(=O)c1[N+](=O)[O-] 4121764 RBIFXRCJJXGRFL-UHFFFAOYSA-N 211.202 0.973 5 40 BCBB O=[N+]([O-])C[C@@H](O)C(Cl)(Cl)Cl 4566458 AVFZWDKRPQVMDL-UWTATZPHSA-N 208.428 0.994 5 40 BCBB O=C1Nc2ccc([N+](=O)[O-])cc2O[C@@H]1CCO 4072885 XFMZSIGEYJLZHN-MRVPVSSYSA-N 238.199 0.677 5 40 BCBB COc1nn([C@@H](C)C(=O)O)cc1[N+](=O)[O-] 4294615 JKGIOJTWKOZSKL-BYPYZUCNSA-N 215.165 0.446 5 40 BCBB N[C@H]1CS(=O)(=O)c2cc([N+](=O)[O-])ccc21 95882086 SHRHUPSBEZUVIX-ZETCQYMHSA-N 228.229 0.382 5 40 BCBB CCn1cc([N+](=O)[O-])cc(C(C)=O)c1=O 72220787 HYZQRKWBALHQHI-UHFFFAOYSA-N 210.189 0.979 5 40 BCBB NC(=O)NC(=O)COc1cccc([N+](=O)[O-])c1 16224179 FNRYLPCJXYDSLM-UHFFFAOYSA-N 239.187 0.169 5 40 BCBB O=[N+]([O-])C1CC([N+](=O)[O-])CC([N+](=O)[O-])C1 100931155 JTFVIQOKVXTRSX-UHFFFAOYSA-N 219.153 0.106 5 40 BCBB CNC(=O)/N=c1\[nH]c2ccc([N+](=O)[O-])cc2[nH]1 13284902 XSGBKKUVKNYNJI-UHFFFAOYSA-N 235.203 0.644 5 40 BCBB Cc1cc(N(C)C)nc(-n2cc([N+](=O)[O-])cn2)n1 5251759 LAIWKFHIYFRVSL-UHFFFAOYSA-N 248.246 0.945 5 40 BCBB Cn1cc([N+](=O)[O-])c(NC[C@H]2CCCO2)n1 95098552 YREGVICKMXAHCH-SSDOTTSWSA-N 226.236 0.919 5 40 BCBB Cc1nn(C)c(N2CCC[C@H](O)C2)c1[N+](=O)[O-] 40437192 RUUWIYYAXPUJOP-QMMMGPOBSA-N 240.263 0.598 5 40 BCBB O=[N+]([O-])c1ccccc1-[n+]1nc2nonc2[nH]1 16450558 GSAMUUDHIYBMCH-UHFFFAOYSA-N 233.167 0.131 5 40 BCBB CCOC(=O)CNc1ccc([N+](=O)[O-])cn1 37472719 JHRJMJQDEVTQBG-UHFFFAOYSA-N 225.204 0.965 5 40 BCBB in-vitro Cn1cc([N+](=O)[O-])c(NC[C@@H]2CCCO2)n1 95098551 YREGVICKMXAHCH-ZETCQYMHSA-N 226.236 0.919 5 40 BCBB SC1=NN=C(c2ccncc2)[N+]12CCOCC2 13550980 DOPIOAQFGIUBKX-UHFFFAOYSA-O 249.319 0.890 5 40 BCBB CN(CCO)c1nc2ccccn2c1[N+](=O)[O-] 12628189 HUMVYCVZTSTWMN-UHFFFAOYSA-N 236.231 0.671 5 40 BCBB C[N+]1(C)CCO[C@](O)(c2ccccc2)C1 3860938 BIGNZUAOMJYPRO-LBPRGKRZSA-N 208.281 0.938 5 40 BCBB in-vitro C=C(C)C(=O)OCC[N+](C)(C)CCC(=O)O 34283218 CSWRCKVZMMKVDC-UHFFFAOYSA-O 230.284 0.657 5 40 BCBB in-vitro NCC[C@H](O)c1ccc(O)c([N+](=O)[O-])c1 1535740709 KWNDHCZUCSNUAT-QMMMGPOBSA-N 212.205 0.683 5 40 BCBB Nc1nc(N2CCC(O)CC2)ccc1[N+](=O)[O-] 94262090 AKMSDPQWPAQLPY-UHFFFAOYSA-N 238.247 0.533 5 40 BCBB Cc1nnc2c3ccccc3[nH]c(=O)n2c1=O 12863382 XZYWQXMUAKLQHF-UHFFFAOYSA-N 228.211 0.239 5 40 BCBB O=[N+]([O-])c1cccn2nc(COCCO)nc12 1579754 ADDPOIQHUZOPNN-UHFFFAOYSA-N 238.203 0.146 5 40 BCBB O=[N+]([O-])C[C@@]12O[C@H]3[C@H]4[C@@H]5[C@H]([C@H]6C[C@H]5[C@@H]3[C@@H]61)[C@H]42 100246366 ONOSZFXFPMJTBZ-WLKUGORSSA-N 219.240 0.788 5 40 BCBB COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])o1 2640184 FFFJEYGZFVJPGD-UHFFFAOYSA-N 242.187 0.481 5 40 BCBB O=C(O)c1nn(CC(F)F)cc1[N+](=O)[O-] 20348888 NZBRUISOPCXFMB-UHFFFAOYSA-N 221.119 0.755 5 40 BCBB O=C(O)[C@@H](CO)Nc1ccccc1[N+](=O)[O-] 72238524 VSERMOBVFDOZHS-SSDOTTSWSA-N 226.188 0.452 5 40 BCBB CC(C)[C@@H](Nc1ccc([N+](=O)[O-])cn1)C(N)=O 95427452 WUKZFCMDFSMOHY-SECBINFHSA-N 238.247 0.912 5 40 BCBB CC(C)NC(=O)c1cc([N+](=O)[O-])cnc1N 97238377 WUCOZTDCPLNAAX-UHFFFAOYSA-N 224.220 0.710 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c2nn(C)nc2c1 218258076 AUSRBFPWFCKWHL-UHFFFAOYSA-N 236.187 0.663 5 40 BCBB O=[N+]([O-])c1ccc(NC(=S)NCCO)cc1 34606890 ALDNAZNKTFSDGP-UHFFFAOYSA-N 241.272 0.874 5 40 BCBB CCOCCCNCc1cc([N+](=O)[O-])nn1C 408715719 CWDXLBHDXMJEPG-UHFFFAOYSA-N 242.279 0.845 5 40 BCBB O=C(NC[C@@H]1CO1)c1ccc([N+](=O)[O-])cc1 95096840 NWKRPNJDIPQMHG-SECBINFHSA-N 222.200 0.723 5 40 BCBB N[C@@H]1CS(=O)(=O)c2cc([N+](=O)[O-])ccc21 95882087 SHRHUPSBEZUVIX-SSDOTTSWSA-N 228.229 0.382 5 40 BCBB CN(C)c1ccc(C(N)=O)cc1[N+](=O)[O-] 8147652 ZVRMZJSDRYQQOY-UHFFFAOYSA-N 209.205 0.760 5 40 BCBB NC(=O)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 45953425 ASTWLUNEGHPCRN-SSDOTTSWSA-N 249.226 0.433 5 40 BCBB CC(C)(C)OC(=O)N1CC[C@@](CO)([N+](=O)[O-])C1 1565504748 BCKWHZDDYNPWJF-SNVBAGLBSA-N 246.263 0.635 5 40 BCBB CN1C[C@@]2([N+](=O)[O-])C=CC[C@@]([N+](=O)[O-])(C1)C2 1757066 UJTVOFSDBXXRSP-BDAKNGLRSA-N 227.220 0.313 5 40 BCBB Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1C(N)=O 4833984 NRYHPKNMNWMIRL-UHFFFAOYSA-N 226.236 0.725 5 40 BCBB CNC(=O)c1cc(C)cc([N+](=O)[O-])c1N 78497479 JWEQLQCYSWCBGN-UHFFFAOYSA-N 209.205 0.845 5 40 BCBB O=C(O)Cc1cn2cccc([N+](=O)[O-])c2n1 89201763 SIDOGMSWNADHIJ-UHFFFAOYSA-N 221.172 0.870 5 40 BCBB NN/C(=C\[N+](=O)[O-])Nc1ccc(F)cc1 1384649 CDKTYLKHBKXPEX-YVMONPNESA-N 212.184 0.777 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c2nn[nH]c2c1 19990331 KWIGQLMUBFNUKV-UHFFFAOYSA-N 209.121 0.774 5 40 BCBB NC(=O)CNc1ccc(F)c([N+](=O)[O-])c1 9836389 XXEXYIYCLXMVBV-UHFFFAOYSA-N 213.168 0.631 5 40 BCBB C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)O 85283 CBMCTOCBSFJMEG-ZCFIWIBFSA-N 238.199 0.798 5 40 BCBB Cc1c([N+](=O)[O-])cc(N)cc1S(=O)(=O)O 1588715 LTYYONSWQIPDTA-UHFFFAOYSA-N 232.217 0.732 5 40 BCBB C[N+]1(CCO)C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 4065016 SXZDIEOMZTVPMJ-RJKRMVDRSA-N 249.334 0.404 5 40 BCBB CCCCNC(=O)c1c([N+](=O)[O-])cnn1C 12396468 SPRCVSUOAWWUSE-UHFFFAOYSA-N 226.236 0.858 5 40 BCBB O=C(O)c1cn(C(F)F)nc1[N+](=O)[O-] 685936567 GZCLYVZSFCFURL-UHFFFAOYSA-N 207.092 0.885 5 40 BCBB O=C1CCN(c2ncccc2[N+](=O)[O-])CCN1 24529093 HOJDXNDJUWXAEL-UHFFFAOYSA-N 236.231 0.316 5 40 BCBB O=C(O)[C@H]1Cc2ccc([N+](=O)[O-])cc2CN1 34428407 DUNHNFQEXKIPND-SECBINFHSA-N 222.200 0.694 5 40 BCBB in-vitro Nc1nnnn1Cc1cccc([N+](=O)[O-])c1 267885 SPEVULARGVCMAO-UHFFFAOYSA-N 220.192 0.212 5 40 BCBB NS(=O)(=O)c1ccc([N+](=O)[O-])c(F)c1 115412659 XJDMLKHQXMWZQN-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB CC(C)C1OCC(CO)([N+](=O)[O-])CO1 5662658 IBZBPIOZBAIPOV-UHFFFAOYSA-N 205.210 0.023 5 40 BCBB COc1coc([C@H](O)[C@H](C)[N+](=O)[O-])cc1=O 480707 VLNFWBYJEHFZAB-SSDLBLMSSA-N 229.188 0.347 5 40 BCBB O=[N+]([O-])c1nn2cccnc2c1[N+](=O)[O-] 4358428 DMHYUMSRQAKROC-UHFFFAOYSA-N 209.121 0.546 5 40 BCBB CC(=O)OCC(C)(COC(C)=O)[N+](=O)[O-] 1681917 DSPDSDLYIAUAQC-UHFFFAOYSA-N 219.193 0.148 5 40 BCBB O=C(OCc1ccno1)[C@H]1C[C@@H]1[N+](=O)[O-] 89885094 JOJLCHDWKQIRJJ-BQBZGAKWSA-N 212.161 0.383 5 40 BCBB Cc1nc(N[C@@H]2COC[C@H]2O)ccc1[N+](=O)[O-] 95990618 JSHLXXSVGBVWNB-VXNVDRBHSA-N 239.231 0.470 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])cc(C(=O)O)c1O 39333317 MLPKVXMBLCQDPZ-UHFFFAOYSA-N 227.128 0.697 5 40 BCBB [O-][n+]1c2cccc(O)c2[n+]([O-])c2cccc(O)c21 5701048 NBMOVCYIGUDQJE-UHFFFAOYSA-N 244.206 0.671 5 40 BCBB NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O 494379 FLZMINOXPIKLBY-UHFFFAOYSA-N 234.167 0.800 5 40 BCBB C[N+](C)(C)CCOC(=O)/C=C/c1c[nH]cn1 13283631 XDPGNNXEHPAHCJ-UHFFFAOYSA-O 224.284 0.672 5 40 BCBB C[C@H](N)C(=O)N(C)Cc1cccc([N+](=O)[O-])c1 37810939 PSKNWBSLJFZECW-QMMMGPOBSA-N 237.259 0.900 5 40 BCBB CN(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 34318601 IGYMVHDFCJKCSQ-UHFFFAOYSA-N 244.272 0.986 5 40 BCBB Nc1nnnn1Cc1ccccc1[N+](=O)[O-] 59475028 GMEPLBRBTOQDPH-UHFFFAOYSA-N 220.192 0.212 5 40 BCBB Cc1cc([N+](=O)[O-])nn1CC(=O)N(C)C 72334191 RWWJGWPGAQEAJJ-UHFFFAOYSA-N 212.209 0.188 5 40 BCBB Cc1nn(CCF)c(C(=O)O)c1[N+](=O)[O-] 95098657 BXSLCVPMNUVIAA-UHFFFAOYSA-N 217.156 0.767 5 40 BCBB O=[N+]([O-])c1ccc(F)c(-n2cnnn2)c1 32627006 PERUBVBZLRARSD-UHFFFAOYSA-N 209.140 0.710 5 40 BCBB in-vitro COC[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])o1 28493796 FJLZZPSHQQEJMX-ZCFIWIBFSA-N 228.204 0.953 5 40 BCBB C[C@]1(O)CC[C@H](O)C[C@@H]1CC[N+](C)(C)[O-] 5495687 OYIIBRVYRBWAJY-DCAQKATOSA-N 217.309 0.863 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c2nonc2c1O 6495023 BROXXEFKSHEIPB-UHFFFAOYSA-N 226.104 0.745 5 40 BCBB Cc1cc(NC(C)(CO)CO)ncc1[N+](=O)[O-] 95412151 OAZYSKOZHUGTQD-UHFFFAOYSA-N 241.247 0.453 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c2nn[nH]c2c1 147965064 ONXPSGIYDVOMHY-UHFFFAOYSA-N 222.160 0.653 5 40 BCBB CN(C)c1nc(N(C)C)nc([N+](C)(C)C)n1 1584938 OJXLNKVCGNDUOB-UHFFFAOYSA-N 225.320 0.200 5 40 BCBB CN1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 805339 DXXMFCDKGQUJPJ-UHFFFAOYSA-N 239.231 0.575 5 40 BCBB NS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 12970887 GSZNPWFQQBVGJP-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB in-vitro CCNC(=O)c1nn(CC)cc1[N+](=O)[O-] 85432379 BRZFVCLRWSKESG-UHFFFAOYSA-N 212.209 0.561 5 40 BCBB O=C1NCCN1C(=O)c1cccc([N+](=O)[O-])c1 104196 QYJANRBBPMPKQI-UHFFFAOYSA-N 235.199 0.760 5 40 BCBB NCC[C@@H](O)c1ccc(O)c([N+](=O)[O-])c1 1535740708 KWNDHCZUCSNUAT-MRVPVSSYSA-N 212.205 0.683 5 40 BCBB Nc1nc(Sc2ccc([N+](=O)[O-])cn2)n[nH]1 13221253 ZISKTPBXSKDYJR-UHFFFAOYSA-N 238.232 0.841 5 40 BCBB c1ccc(C[N+]23CN4CN(CN(C4)C2)C3)cc1 19319508 ZEBQXLTZNFGHKI-UHFFFAOYSA-N 231.323 0.695 5 40 BCBB in-vitro CCOC(=O)COc1ccc([N+](=O)[O-])cn1 5585678 KHWQMEYLAIAXFH-UHFFFAOYSA-N 226.188 0.932 5 40 BCBB O=C(O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 3399129 IAYXNJKBPWCTMZ-UHFFFAOYSA-N 238.155 0.587 5 40 BCBB Nc1nc2c([N+](=O)[O-])ccc(Cl)n2n1 757130972 NEAVCNLGQAMHGY-UHFFFAOYSA-N 213.584 0.873 5 40 BCBB O=C(CNCCO)Nc1ccc([N+](=O)[O-])cc1 42684368 AHPMAFJQBIMZPQ-UHFFFAOYSA-N 239.231 0.115 5 40 BCBB CC(C)(C)c1nn(CCO)c(N)c1[N+](=O)[O-] 87418561 NKOJJBOHERZNSB-UHFFFAOYSA-N 228.252 0.663 5 40 BCBB CN1C[C@@]2([N+](=O)[O-])C=CC[C@]([N+](=O)[O-])(C1)C2 104182236 UJTVOFSDBXXRSP-RKDXNWHRSA-N 227.220 0.313 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)N[C@H](O)[C@H](O)N2 5955886 UECLGMYJNJOYES-JGVFFNPUSA-N 211.177 0.069 5 40 BCBB O=C(O)Cn1nnc(-c2ccc([N+](=O)[O-])cc2)n1 4535272 PUGVGINCJMNNBG-UHFFFAOYSA-N 249.186 0.333 5 40 BCBB CN(C)CCNc1ccc([N+](=O)[O-])cn1 8716957 ITTCITPABROWSB-UHFFFAOYSA-N 210.237 0.963 5 40 BCBB O=[N+]([O-])c1c(N2CC[C@@H](O)C2)nc2ccccn12 95948161 IUYARNHPLKISSI-MRVPVSSYSA-N 248.242 0.814 5 40 BCBB CCOc1nn(CCC(=O)O)cc1[N+](=O)[O-] 253397962 GIBLBTZWKKGZBC-UHFFFAOYSA-N 229.192 0.665 5 40 BCBB Cn1cc(C(=O)n2cccn2)c([N+](=O)[O-])n1 508131 WKQMEKXLRZELRI-UHFFFAOYSA-N 221.176 0.213 5 40 BCBB Cn1c2nc(=O)[nH]c(=O)c-2cc2ccccc21 1698103 VPPVXLHZEZARQZ-UHFFFAOYSA-N 227.223 0.727 5 40 BCBB in-vitro Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C(=O)O 2565516 OBJZCQXAXGNLGZ-UHFFFAOYSA-N 227.132 0.783 5 40 BCBB CCOC(=O)Cn1ncc([N+](=O)[O-])c1C 96029587 XWINSRDZLQOIPW-UHFFFAOYSA-N 213.193 0.663 5 40 BCBB C[C@@H](Oc1ccccc1[N+](=O)[O-])C(N)=O 5109314 KANYHDSBWVYJSD-ZCFIWIBFSA-N 210.189 0.847 5 40 BCBB O=[N+]([O-])c1cccc(OC[C@H](O)CO)c1 6092500 HJYXCTLKGAOVHQ-MRVPVSSYSA-N 213.189 0.327 5 40 BCBB O=C(O)[C@H]1COc2cc([N+](=O)[O-])ccc2O1 810226 JSFQNXNIULHEFN-MRVPVSSYSA-N 225.156 0.819 5 40 BCBB O=c1[nH]c2ncccc2c(O)c1[N+](=O)[O-] 6161237 LETPTABXMDGFBW-UHFFFAOYSA-N 207.145 0.537 5 40 BCBB Cc1nc(NCCO)c([N+](=O)[O-])n1C 12469998 ITEVQMMYCSWKMC-UHFFFAOYSA-N 200.198 0.041 5 40 BCBB CCn1cc([N+](=O)[O-])c(-n2cccn2)n1 253403795 QKTCPNVWLVOVNB-UHFFFAOYSA-N 207.193 0.997 5 40 BCBB CC(=O)CCn1nc([N+](=O)[O-])nc1[N+](=O)[O-] 4653980 NYTIEZKKTYJYDU-UHFFFAOYSA-N 229.152 0.074 5 40 BCBB c1ccc(CC[N+]23CN4CN(CN(C4)C2)C3)cc1 19319178 WMWGBUKWWCYBDD-UHFFFAOYSA-N 245.350 0.738 5 40 BCBB CC(=O)Nc1ccc(NCCO)c([N+](=O)[O-])c1 34446681 ATLZGQJPRLSBPZ-UHFFFAOYSA-N 239.231 0.957 5 40 BCBB C[C@H](N)C(=O)NCc1cccc([N+](=O)[O-])c1 28133189 KQXYOMCEWZXKAE-ZETCQYMHSA-N 223.232 0.558 5 40 BCBB CC(=O)Nc1cc2c(c([N+](=O)[O-])c1)OC[C@@H]2O 66091331 ZQXSJZQVPYEGML-VIFPVBQESA-N 238.199 0.979 5 40 BCBB O=[N+]([O-])c1cnc(NC(CO)CO)c(Cl)c1 78409714 YTKAXBSQMQPKSA-UHFFFAOYSA-N 247.638 0.408 5 40 BCBB Cc1nn([C@@H](C)C(N)=O)c(C)c1[N+](=O)[O-] 2618835 VUNZBLOCMHYYFO-LURJTMIESA-N 212.209 0.454 5 40 BCBB CS(=O)(=O)c1ccc(CO)c([N+](=O)[O-])c1 25336378 XDJPKTPTLIVLDS-UHFFFAOYSA-N 231.229 0.491 5 40 BCBB in-vitro COC(=O)c1cn(CCC(=O)O)nc1[N+](=O)[O-] 408716157 JMNDZRYMNMPNTJ-UHFFFAOYSA-N 243.175 0.053 5 40 BCBB CN(C)S(=O)(=O)Cc1cccc([N+](=O)[O-])c1 20106747 BUWUOZSUKVLQRR-UHFFFAOYSA-N 244.272 0.986 5 40 BCBB O=[N+]([O-])c1ncn(CCCCCCO)n1 95425877 TZNGWYLBZXRMIB-UHFFFAOYSA-N 214.225 0.739 5 40 BCBB Nc1c([N+](=O)[O-])cnn1CCCCCO 95988718 OYEQXJOMRAQZTQ-UHFFFAOYSA-N 214.225 0.536 5 40 BCBB COC(=O)[C@H]1[C@@H]2CC[C@@H](C[C@H]1O)[N+]2(C)C 104095933 PRTGVCOFANEHJQ-QEYWKRMJSA-N 214.285 0.148 5 40 BCBB O=[N+]([O-])C[C@]12O[C@H]3[C@H]4[C@@H]5[C@@H]6C[C@H]([C@@H]5[C@H]41)[C@@H]2[C@@H]63 100246359 ONOSZFXFPMJTBZ-WTPLBZGWSA-N 219.240 0.788 5 40 BCBB NS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1 35677902 UFKZHNIFLPRVPB-UHFFFAOYSA-N 230.245 0.426 5 40 BCBB in-vitro C[N+]1([C@@H]2C[C@@H]3CC[C@@H]2C3=O)CCOCC1 104098355 ZYOJMOBGJMTZFJ-GARJFASQSA-N 210.297 0.831 5 40 BCBB C[C@H]1CN1P1(=O)OCC(C)([N+](=O)[O-])CO1 4962202 HRHDTUXTJNZJNC-FGTHURKGSA-N 236.164 0.881 5 40 BCBB Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 3888883 UKMPWBSPQZCXLA-UHFFFAOYSA-N 209.161 0.508 5 40 BCBB in-vitro C[C@@H]1CC(=O)[C@H](CC(=O)O)[C@@H]1C[N+](=O)[O-] 4529336 YPCIKCQPODDZAT-FSDSQADBSA-N 215.205 0.579 5 40 BCBB biogenic,in-vitro COC(=O)[C@H](N)c1ccc([N+](=O)[O-])cc1 14984861 JQQJZFRFDFGUPU-MRVPVSSYSA-N 210.189 0.768 5 40 BCBB CC(=O)c1ccc([N+](=O)[O-])cc1C(N)=O 5553397 IJAYHYFLJGXLFV-UHFFFAOYSA-N 208.173 0.896 5 40 BCBB Cc1cc([N+](=O)[O-])nn1CC(=O)N1CCCC1 826475 MMGMRRWJHQZJBB-UHFFFAOYSA-N 238.247 0.722 5 40 BCBB Cn1nc([N+](=O)[O-])cc1CN1CCOCC1 72209672 MITUGFPITLPCNO-UHFFFAOYSA-N 226.236 0.161 5 40 BCBB NC(=O)CCNc1ccccc1[N+](=O)[O-] 35206704 WZTVOPGVBBHZGN-UHFFFAOYSA-N 209.205 0.882 5 40 BCBB in-vitro NC(=O)c1cn(CC(F)F)nc1[N+](=O)[O-] 96029585 OYZHJOYLEVBSRE-UHFFFAOYSA-N 220.135 0.155 5 40 BCBB CCOc1nn([C@@H](C)C(=O)OC)cc1[N+](=O)[O-] 253398894 HURNCJIEMJBEBI-LURJTMIESA-N 243.219 0.924 5 40 BCBB NC(=O)[C@H]1CCCN1c1ncccc1[N+](=O)[O-] 23623516 IUJOMOBBAZFJLP-SSDOTTSWSA-N 236.231 0.444 5 40 BCBB O=C1CCCN1CCCn1cc([N+](=O)[O-])cn1 96413680 AMZCFJOGQTWXNS-UHFFFAOYSA-N 238.247 0.804 5 40 BCBB O=C1NCCN1C(=O)c1ccccc1[N+](=O)[O-] 95117298 BYVBSXCNWUJKOO-UHFFFAOYSA-N 235.199 0.760 5 40 BCBB CCn1nc([N+](=O)[O-])nc1Br 57341290 VPPKSWSGTPWMLX-UHFFFAOYSA-N 221.014 0.969 5 40 BCBB CC[C@@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)O 36748988 GNWQCEXIZYRDKD-ZCFIWIBFSA-N 242.235 0.912 5 40 BCBB CS(=O)(=O)Cc1cc(C(=O)O)oc1[N+](=O)[O-] 96532833 CRMOMGZSAJKGPA-UHFFFAOYSA-N 249.200 0.431 5 40 BCBB CNC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 1995088 GVKLFFIPALKQFM-UHFFFAOYSA-N 224.172 0.653 5 40 BCBB in-vitro C[N+]1(C)CCO[C@@](O)(c2ccccc2)C1 3860939 BIGNZUAOMJYPRO-GFCCVEGCSA-N 208.281 0.938 5 40 BCBB in-vitro O=Cc1cnn(-c2ccc([N+](=O)[O-])cc2)n1 5579972 PAOQMARVSGBRKP-UHFFFAOYSA-N 218.172 0.988 5 40 BCBB CCOc1nn(CC(=O)OC)cc1[N+](=O)[O-] 253403765 QKDYERKGXUNVHF-UHFFFAOYSA-N 229.192 0.363 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)N[C@H](O)[C@@H](O)N2 5955889 UECLGMYJNJOYES-HTQZYQBOSA-N 211.177 0.069 5 40 BCBB COc1ccc2c(c1[N+](=O)[O-])NC(=O)C2=O 139805162 GGEPSWSUKKVGTN-UHFFFAOYSA-N 222.156 0.738 5 40 BCBB Cn1nnnc1Sc1ccc([N+](=O)[O-])cn1 984043 SOTQHANCZQTKJN-UHFFFAOYSA-N 238.232 0.665 5 40 BCBB CCCNC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1 97048030 XPQIIILGRSKMBM-ZETCQYMHSA-N 226.236 0.879 5 40 BCBB NNc1ccc(S(=O)(=O)O)cc1[N+](=O)[O-] 96125829 DZRLKMNAQIOEOG-UHFFFAOYSA-N 233.205 0.127 5 40 BCBB COC(=O)c1cn(-c2ccc([N+](=O)[O-])cn2)nn1 58282289 OFNAJFFIKJAWEH-UHFFFAOYSA-N 249.186 0.357 5 40 BCBB Cn1cc([N+](=O)[O-])c(C(=O)N2CCCCC2)n1 55440 HGRCCBKXBDNGPL-UHFFFAOYSA-N 238.247 0.954 5 40 BCBB CN(CC(=O)O)C(=O)c1ccc([N+](=O)[O-])cc1 13822449 UMZUJULAJNWKSG-UHFFFAOYSA-N 238.199 0.751 5 40 BCBB NS(=O)(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 4013978 XBQMHUKBFHTGGC-UHFFFAOYSA-N 247.188 0.150 5 40 BCBB Cn1c(=O)n(C)c2ncc([N+](=O)[O-])cc21 549126 HCYCOONAXVQVRT-UHFFFAOYSA-N 208.177 0.180 5 40 BCBB O=[N+]([O-])c1ccn(Cn2ccc([N+](=O)[O-])n2)n1 72334141 KNCSOPJMNAPBCI-UHFFFAOYSA-N 238.163 0.402 5 40 BCBB CN(C)C=Cc1c[n+]([O-])ccc1[N+](=O)[O-] 1857793021 FGBBTNYRURUPDI-UHFFFAOYSA-N 209.205 0.761 5 40 BCBB O=[N+]([O-])c1ccc(S(=O)(=O)O)nc1 6088381 NEQHFODISSWYGD-UHFFFAOYSA-N 204.163 0.237 5 40 BCBB CCOC(=O)CN(C)c1ccncc1[N+](=O)[O-] 50086997 PCVJGLXCSCOWGW-UHFFFAOYSA-N 239.231 0.989 5 40 BCBB in-vitro Cc1c([N+](=O)[O-])c(NCCO)nn1C 4014786 UQNIGAUTLLNWIH-UHFFFAOYSA-N 200.198 0.041 5 40 BCBB CC(C)=CC[N+]12CN3CN(CN(C3)C1)C2 19319186 JJTRKLBQLPXCQW-UHFFFAOYSA-N 209.317 0.461 5 40 BCBB CCn1cc([N+](=O)[O-])cc(C(=O)OC)c1=O 43929420 CYJVNILLIYQDGJ-UHFFFAOYSA-N 226.188 0.563 5 40 BCBB Cc1ccc(CNC(=O)[C@@H]2C[C@@H]2[N+](=O)[O-])n1C 32933163 CQJFPTGXTSJWNO-ZJUUUORDSA-N 237.259 0.615 5 40 BCBB C[C@](O)(CO)CNc1cc(F)ccc1[N+](=O)[O-] 90287803 SLUKQZJCIQFADY-SNVBAGLBSA-N 244.222 0.889 5 40 BCBB CCCCNC(=O)Cn1cnc([N+](=O)[O-])n1 3056929 WUBNTGPRUNECAV-UHFFFAOYSA-N 227.224 0.103 5 40 BCBB CCOC(=O)c1cc([N+](=O)[O-])cnc1N 20436583 IXVHWCFQORHXNA-UHFFFAOYSA-N 211.177 0.749 5 40 BCBB Cc1ccc[n+](-c2ncnc(N)c2[N+](=O)[O-])c1 5446948 MMLQTKURQOBJHL-UHFFFAOYSA-N 232.223 0.552 5 40 BCBB Nn1cc(-c2cccc([N+](=O)[O-])c2)nn1 16399984 KRAAGXQMUDRPBW-UHFFFAOYSA-N 205.177 0.567 5 40 BCBB O=[N+]([O-])c1ccn(CC2CCNCC2)n1 43497898 UQSGMJKUHLBZLI-UHFFFAOYSA-N 210.237 0.791 5 40 BCBB NC(=S)Nc1cc([N+](=O)[O-])ccc1O 20154608 JTSHCSIKQFGAFI-UHFFFAOYSA-N 213.218 0.956 5 40 BCBB COc1coc([C@H](O)[C@@H](C)[N+](=O)[O-])cc1=O 480708 VLNFWBYJEHFZAB-MLUIRONXSA-N 229.188 0.347 5 40 BCBB O=[N+]([O-])c1cccnc1Nc1cnn(CCO)c1 48962939 JJMNCCMLIAFNMO-UHFFFAOYSA-N 249.230 0.922 5 40 BCBB CNC(=O)CN1CCc2ccc([N+](=O)[O-])cc2C1 88616524 AQLVANKCHUTEDL-UHFFFAOYSA-N 249.270 0.699 5 40 BCBB O=C(Nc1ccccc1[N+](=O)[O-])c1nc[nH]n1 4866361 XAHHTQRIOBBDIY-UHFFFAOYSA-N 233.187 0.965 5 40 BCBB Cn1ncc([N+](=O)[O-])c1C(=O)N1CCCC1 2807253 KTVVYYLMWBKLEZ-UHFFFAOYSA-N 224.220 0.564 5 40 BCBB COC[C@H](C)NC(=O)c1ccc([N+](=O)[O-])o1 28493799 FJLZZPSHQQEJMX-LURJTMIESA-N 228.204 0.953 5 40 BCBB Cn1cnc([N+](=O)[O-])c1NCCCO 8308654 KQOPLAVBJDHIMC-UHFFFAOYSA-N 200.198 0.123 5 40 BCBB Cc1cc(C(=O)NCC(=O)O)ccc1[N+](=O)[O-] 3289345 MQWUJWRMCMDPTG-UHFFFAOYSA-N 238.199 0.718 5 40 BCBB in-vitro O=C(O)CNC(=O)c1ccc([N+](=O)[O-])o1 2617559 UOFUMXXXRWUIMT-UHFFFAOYSA-N 214.133 0.002 5 40 BCBB CCS(=O)(=O)Cc1nc(C)n(C)c1[N+](=O)[O-] 96532818 CQDDDIYMPIEFOS-UHFFFAOYSA-N 247.276 0.571 5 40 BCBB O=C(O)c1cnn(Cn2cc([N+](=O)[O-])cn2)c1 12357804 MBOBCUQHWNOUIL-UHFFFAOYSA-N 237.175 0.192 5 40 BCBB COC(=O)C(=O)Cc1ccccc1[N+](=O)[O-] 16189591 BJUFXOPELRQGNJ-UHFFFAOYSA-N 223.184 0.879 5 40 BCBB Cc1ccc2nc3c(=O)n(C)c(=O)[nH]c3nc2c1 22339442 DDVYIHZWMBBZDD-UHFFFAOYSA-N 242.238 0.478 5 40 BCBB CCOC(=O)[C@@H](C)[C@](C)(O)C[N+](=O)[O-] 5459580 JLKMVZMXSKOHLP-HTRCEHHLSA-N 205.210 0.213 5 40 BCBB COC(=O)[C@H](C)Nc1ncccc1[N+](=O)[O-] 34287079 UQMSOGUSOHTFKN-LURJTMIESA-N 225.204 0.963 5 40 BCBB in-vitro Cn1cnc([N+](=O)[O-])c1N1CC(O)(C2CC2)C1 89667264 GSFSCOYJQVCPGB-UHFFFAOYSA-N 238.247 0.289 5 40 BCBB O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccnc1 4686663 PPVQVJNOZWVPAW-UHFFFAOYSA-N 247.214 0.825 5 40 BCBB O=[N+]([O-])C1(CO)COC2(CCCCC2)OC1 34513928 VKJYMZGTLPGDFR-UHFFFAOYSA-N 231.248 0.701 5 40 BCBB O=[N+]([O-])c1ccccc1OC[C@H]1CNCCO1 80745178 HTDGBNBKVQVFOZ-SECBINFHSA-N 238.243 0.962 5 40 BCBB O=C(O)c1[nH]nc2ncc([N+](=O)[O-])cc12 95836821 IKRZBWRXRGSIBG-UHFFFAOYSA-N 208.133 0.564 5 40 BCBB Cc1ccc([N+](=O)[O-])c(C)c1S(N)(=O)=O 36666991 WNCHFVSCDIBIKS-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB O=[N+]([O-])[C@@H]1CCN(Cc2ccccc2)[C@@H]1O 13535495 GJSZKSQTYVGJMO-GHMZBOCLSA-N 222.244 0.856 5 40 BCBB CONC(=O)c1ccc(N)c([N+](=O)[O-])c1 10636000 CRFMXAJQIJIDBU-UHFFFAOYSA-N 211.177 0.468 5 40 BCBB O=[N+]([O-])c1cccnc1N1CC[C@H](CO)C1 51886291 BOLXNEAVLLPMDD-QMMMGPOBSA-N 223.232 0.808 5 40 BCBB O=c1nnc(-c2ccc([N+](=O)[O-])o2)c(O)[nH]1 16991385 OYQZCMCEAPUWHK-UHFFFAOYSA-N 224.132 0.039 5 40 BCBB O=[N+]([O-])C[C@@H](O)c1cnn(-c2ccccc2)n1 132720 CDAYIXWUSWBNET-SNVBAGLBSA-N 234.215 0.577 5 40 BCBB C[C@H](CCO)[N+]1(C)CC[N+](C)(C)CC1 4866424 RXQJUVZQCIHWEF-LLVKDONJSA-N 202.342 0.294 5 40 BCBB N[C@H](C(=O)O)c1ccc(O)c([N+](=O)[O-])c1 42854204 WPJSXUYBLQGKHR-ZETCQYMHSA-N 212.161 0.385 5 40 BCBB CS(=O)(=O)C[C@H](O)c1ccc([N+](=O)[O-])cc1 95095242 JWHMTLPMBPXJOP-VIFPVBQESA-N 245.256 0.673 5 40 BCBB COC(C)(Cn1cc([N+](=O)[O-])cn1)OC 67800443 QOKMFFBBJICFIT-UHFFFAOYSA-N 215.209 0.800 5 40 BCBB O=[N+]([O-])c1cc(CO)c(O)c([N+](=O)[O-])c1 32250330 FAGQEAMUOCVOIY-UHFFFAOYSA-N 214.133 0.701 5 40 BCBB C[C@H]1[C@H](C)N1C[C@H](O)Cn1ccnc1[N+](=O)[O-] 2022221 VKUQQJFQNDTATQ-XHNCKOQMSA-N 240.263 0.245 5 40 BCBB in-vitro O=[N+]([O-])c1cccc(-n2cc(CO)nn2)c1 52221032 HGIWSNWQEBGCHT-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB O=C(O)[C@H](CO)Nc1ccccc1[N+](=O)[O-] 72238523 VSERMOBVFDOZHS-ZETCQYMHSA-N 226.188 0.452 5 40 BCBB O=C(O)c1n[nH]c2c([N+](=O)[O-])cccc2c1=O 149704025 NRTQDTVOLOUSLG-UHFFFAOYSA-N 235.155 0.530 5 40 BCBB O=C(O)c1ccc([N+](=O)[O-])c(C(=O)O)n1 4473030 NZEUUFGQGLSAOL-UHFFFAOYSA-N 212.117 0.386 5 40 BCBB CCCc1c([N+](=O)[O-])c(C(=O)O)nn1C 65743375 QBLDBZSMOABVNB-UHFFFAOYSA-N 213.193 0.979 5 40 BCBB in-vitro CNC(=O)COC(=O)c1cccc([N+](=O)[O-])c1 3292714 KMVXLMMQNWXGMT-UHFFFAOYSA-N 238.199 0.498 5 40 BCBB O=C(O)Cn1nnc(-c2ccccc2[N+](=O)[O-])n1 101207806 QCYSKGDTADGVOR-UHFFFAOYSA-N 249.186 0.333 5 40 BCBB Nc1nnc(OCc2ccc([N+](=O)[O-])cc2)[nH]1 225970406 PUOSWNMXVHNGDD-UHFFFAOYSA-N 235.203 0.874 5 40 BCBB CC1(C)OCC([N+](=O)[O-])([N+](=O)[O-])CO1 19319260 CLCUHNNEIHFIEK-UHFFFAOYSA-N 206.154 0.019 5 40 BCBB O=C1CCN[C@H](c2ccc([N+](=O)[O-])cc2)N1 209610184 VMORCXRCBGFOGY-JTQLQIEISA-N 221.216 0.703 5 40 BCBB O=[N+]([O-])c1cccnc1S(=O)(=O)O 6088376 WZBDCLMTYAGWKV-UHFFFAOYSA-N 204.163 0.237 5 40 BCBB Nc1nc(NCc2cccnc2)ncc1[N+](=O)[O-] 71287787 VQZZADOFJZGNRG-UHFFFAOYSA-N 246.230 0.974 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])cc(S(=O)(=O)O)c1 3844752 ZRPMYHWMBFITIP-UHFFFAOYSA-N 247.184 0.540 5 40 BCBB biogenic Nc1cc(=O)[nH]c(-c2ccccc2[N+](=O)[O-])n1 2597886 ZMXSUKJKSCTRMW-UHFFFAOYSA-N 232.199 0.927 5 40 BCBB CCOC(=O)c1nn(CCF)cc1[N+](=O)[O-] 408716137 JHRKWAPYPBVMPS-UHFFFAOYSA-N 231.183 0.938 5 40 BCBB CN(CCCN)Cc1cc([N+](=O)[O-])n(C)n1 408716298 LDBXQRJHPPGRIK-UHFFFAOYSA-N 227.268 0.109 5 40 BCBB COC(=O)c1[nH]c2ccc([N+](=O)[O-])cc2[n+]1[O-] 1706484 HWDZEKZNVCNICC-UHFFFAOYSA-N 237.171 0.496 5 40 BCBB O=C(O)[C@@H]1Cc2cc([N+](=O)[O-])c(O)cc2CN1 521824911 LPDMEZPQPQBQJD-ZETCQYMHSA-N 238.199 0.399 5 40 BCBB NC(=O)c1cc([N+](=O)[O-])c(N)c([N+](=O)[O-])c1 4013989 BNVZFENSTYWDDB-UHFFFAOYSA-N 226.148 0.184 5 40 BCBB O=[N+]([O-])C[C@H](O)C(Cl)(Cl)Cl 4566457 AVFZWDKRPQVMDL-REOHCLBHSA-N 208.428 0.994 5 40 BCBB N[C@@H](C(=O)O)[C@H](O)c1cccc([N+](=O)[O-])c1 226260 MBHARJQAJLMPIU-HTQZYQBOSA-N 226.188 0.040 5 40 BCBB biogenic,in-vitro Cc1ccc2nnn3c(=N)nc(N)nc3c2c1 8627791 KJXYFDKLTGXJNA-UHFFFAOYSA-N 227.231 0.043 5 40 BCBB COc1nn([C@H](C)C(=O)O)cc1[N+](=O)[O-] 4294616 JKGIOJTWKOZSKL-SCSAIBSYSA-N 215.165 0.446 5 40 BCBB O=C(O)C[S@](=O)c1ccc([N+](=O)[O-])cc1 34295092 QPJSCXVOHBMWNG-OAHLLOKOSA-N 229.213 0.787 5 40 BCBB in-vitro O=c1c[n+](-c2cccc([N+](=O)[O-])c2)[nH]o1 6535055 CEDUMPWAGWHKCT-UHFFFAOYSA-O 208.153 0.153 5 40 BCBB C[C@H](N)C(=O)NCc1ccc([N+](=O)[O-])cc1 37668483 XELDMMLRFWNMOD-ZETCQYMHSA-N 223.232 0.558 5 40 BCBB COC(=O)[C@@H](N)c1ccccc1[N+](=O)[O-] 95635310 URNHSHZABXHMQB-QMMMGPOBSA-N 210.189 0.768 5 40 BCBB in-vitro O=C(c1[nH]cnc1[N+](=O)[O-])N1CCCC1 4876791 ZEKNSMMTMLGIHM-UHFFFAOYSA-N 210.193 0.554 5 40 BCBB O=C(c1ccccc1[N+](=O)[O-])N1CCNCC1 21952384 MFGWKYNLNOWMRZ-UHFFFAOYSA-N 235.243 0.640 5 40 BCBB COC(=O)c1c([N+](=O)[O-])c([N+](=O)[O-])nn1C 526049377 DDIUNJOYLGVTAA-UHFFFAOYSA-N 230.136 0.023 5 40 BCBB NC1=NN[C@@H](c2cccc([N+](=O)[O-])c2)O1 482252 LAUOCRLPZOGYRF-SSDOTTSWSA-N 208.177 0.443 5 40 BCBB Nc1nc(N)c([N+](=O)[O-])cc1Br 71254866 FWDQLQOZLBWALU-UHFFFAOYSA-N 233.025 0.917 5 40 BCBB C[C@@H]1CC(=O)[C@@H](CC(=O)O)[C@H]1C[N+](=O)[O-] 5880966 YPCIKCQPODDZAT-VQVTYTSYSA-N 215.205 0.579 5 40 BCBB biogenic,in-vitro CCOC(=O)C[C@H](C(=O)OCC)[C@@H](C)[N+](=O)[O-] 32911431 GVCIHMUGJCWCKR-SFYZADRCSA-N 247.247 0.784 5 40 BCBB CCOC(=O)[C@H](CC)[C@@](C)(O)C[N+](=O)[O-] 5467617 POFPSRKAOLOFKX-CBAPKCEASA-N 219.237 0.603 5 40 BCBB CNC(=S)NC(=O)c1cccc([N+](=O)[O-])c1 12138135 BUQFLDGQPOPXDV-UHFFFAOYSA-N 239.256 0.829 5 40 BCBB COc1cc([N+](=O)[O-])ccc1S(N)(=O)=O 32403391 IDPBJHBJQTTZKI-UHFFFAOYSA-N 232.217 0.251 5 40 BCBB O=c1[nH]c2c([N+](=O)[O-])cccc2c(=O)o1 21982305 XKFUPFXKLACMEG-UHFFFAOYSA-N 208.129 0.390 5 40 BCBB Cn1c(-c2ccc([N+](=O)[O-])cc2)n[nH]c1=O 104766323 BHHNCQBIEIDRBH-UHFFFAOYSA-N 220.188 0.684 5 40 BCBB CN1C(=O)COc2c1cccc2[N+](=O)[O-] 31773327 UIEYVWPPIZRUSN-UHFFFAOYSA-N 208.173 0.950 5 40 BCBB NC1=NN[C@H](c2cccc([N+](=O)[O-])c2)O1 482251 LAUOCRLPZOGYRF-ZETCQYMHSA-N 208.177 0.443 5 40 BCBB O=[N+]([O-])c1nccn1C[C@H](O)c1ccncc1 1508640 KUMYMICMJOLSMD-VIFPVBQESA-N 234.215 0.920 5 40 BCBB CCC(=O)Oc1cc(C)[nH]c(=O)c1[N+](=O)[O-] 4248318 GLPUNTYXIJSKPV-UHFFFAOYSA-N 226.188 0.907 5 40 BCBB O=c1[nH]c(=O)c2cc([N+](=O)[O-])ccc2o1 1681732 SBAMYDGWXQMALO-UHFFFAOYSA-N 208.129 0.390 5 40 BCBB O=Cc1cn(-c2ccc([N+](=O)[O-])cc2)nn1 3844436 YGHWZZLJKCSTCA-UHFFFAOYSA-N 218.172 0.988 5 40 BCBB biogenic O=C1NC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 5663512 MNJMVTWJRLAWSN-UHFFFAOYSA-N 235.155 0.178 5 40 BCBB CC[C@@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 62022626 AKZLSWXGYBUTOL-YFKPBYRVSA-N 227.224 0.150 5 40 BCBB COc1cccc([C@@H](N)C(=O)O)c1[N+](=O)[O-] 199810020 COYXMYINEKGECW-SSDOTTSWSA-N 226.188 0.688 5 40 BCBB CS(=O)(=O)c1cc([N+](=O)[O-])ccc1O 15443205 SFPGVYIDXBKMAD-UHFFFAOYSA-N 217.202 0.704 5 40 BCBB in-vitro NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] 38342382 ACUFLNWNUQBRFN-UHFFFAOYSA-N 236.636 0.896 5 40 BCBB CC1(C)O[C@@H](C[N+](=O)[O-])[C@@H](C[N+](=O)[O-])O1 98174839 JIAVUKRQLADEDA-OLQVQODUSA-N 220.181 0.060 5 40 BCBB Cc1ccc([C@@H](N)C(=O)O)cc1[N+](=O)[O-] 199810379 CADHYKIGVGHPAN-MRVPVSSYSA-N 210.189 0.988 5 40 BCBB CC[C@](C)(NC(=O)[C@@H]1C[C@@H]1[N+](=O)[O-])C(=O)OC 65476000 KJECIIZOKMHFCI-FWWHASMVSA-N 244.247 0.110 5 40 BCBB C[C@H]1[C@H](C)N1C[C@@H](O)Cn1ccnc1[N+](=O)[O-] 13099551 VKUQQJFQNDTATQ-CIUDSAMLSA-N 240.263 0.245 5 40 BCBB O=[N+]([O-])c1ccc(N2CC[C@H](CO)C2)nc1 51886337 WNXFFTGFJKWNPT-QMMMGPOBSA-N 223.232 0.808 5 40 BCBB CCCNC(=O)CCn1ccc([N+](=O)[O-])n1 2787477 RAZAXTDCVPPUPG-UHFFFAOYSA-N 226.236 0.708 5 40 BCBB O=[N+]([O-])c1cc2n[nH]nc2c2n[nH]nc12 4115104 KZIPBQDGNMXXFG-UHFFFAOYSA-N 205.137 0.137 5 40 BCBB O=C(Nn1cnnc1)c1ccccc1[N+](=O)[O-] 6322863 HRNJRDKFTWISDF-UHFFFAOYSA-N 233.187 0.570 5 40 BCBB COc1ccc([N+](=O)[O-])c(CC(=O)C(=O)O)c1 1711668 YYBSGOFFQARTPP-UHFFFAOYSA-N 239.183 0.800 5 40 BCBB Nc1c([N+](=O)[O-])nnc2nc(C(F)(F)F)nn12 4193814 KHLASIUDTJOONS-UHFFFAOYSA-N 249.112 0.029 5 40 BCBB O=C1CC[C@H](CNc2ccc([N+](=O)[O-])cn2)N1 69930517 YUZJWICXZSNIED-SSDOTTSWSA-N 236.231 0.680 5 40 BCBB C[n+]1ccc(C(=O)NCCC[N+](C)(C)C)cc1 95115864 QJXDTJUADOWBOX-UHFFFAOYSA-O 237.347 0.337 5 40 BCBB CCOc1nn(CC(=O)O)cc1[N+](=O)[O-] 253394177 ARMICJZRVTWWSU-UHFFFAOYSA-N 215.165 0.275 5 40 BCBB Cc1nc(SCC(N)=O)c([N+](=O)[O-])[nH]1 4574512 JSWQHEXCIKNKBI-UHFFFAOYSA-N 216.222 0.204 5 40 BCBB O=[N+]([O-])c1ccc(N2CC[C@H](O)C2)nc1 61707392 USIKCAKKNZHNLC-QMMMGPOBSA-N 209.205 0.561 5 40 BCBB Cc1nc(N[C@@H]2COC[C@@H]2O)ccc1[N+](=O)[O-] 95990616 JSHLXXSVGBVWNB-APPZFPTMSA-N 239.231 0.470 5 40 BCBB NC(=O)COC(=O)c1ccccc1[N+](=O)[O-] 2655560 HUAHZPIKENDURZ-UHFFFAOYSA-N 224.172 0.237 5 40 BCBB CN(CCN)Cc1cccc([N+](=O)[O-])c1 54416839 MFIRAEQKHDHBLP-UHFFFAOYSA-N 209.249 0.985 5 40 BCBB CCCCNC(=O)c1nn(C)cc1[N+](=O)[O-] 2738515 FGRUBEYWWADAOW-UHFFFAOYSA-N 226.236 0.858 5 40 BCBB O=C(O)c1cc(C(O)O)cc([N+](=O)[O-])c1 33799823 IIYBCLGLPQDANR-UHFFFAOYSA-N 213.145 0.276 5 40 BCBB COc1cc(-n2cnnn2)cc([N+](=O)[O-])c1 12418310 VCQQRANUVNZJSQ-UHFFFAOYSA-N 221.176 0.579 5 40 BCBB CCOc1nn([C@H](C)C(=O)O)cc1[N+](=O)[O-] 253399467 JKUJWIZRUWNYKG-RXMQYKEDSA-N 229.192 0.836 5 40 BCBB O=[N+]([O-])c1cn(Cc2nnnn2C2CC2)cn1 12778539 UFWBZFOJQTXQPC-UHFFFAOYSA-N 235.207 0.161 5 40 BCBB Cc1cc([N+](=O)[O-])cnc1NC(CO)CO 83694491 ZLWGCLHAKMWZPL-UHFFFAOYSA-N 227.220 0.063 5 40 BCBB Cn1cnc([N+](=O)[O-])c1SCC(=O)O 3953954 TUQQNQSADKYHNI-UHFFFAOYSA-N 217.206 0.505 5 40 BCBB in-vitro Nc1ccc([N+](=O)[O-])c(S(=O)(=O)O)c1 5158999 YQCKQDZVUQEQFT-UHFFFAOYSA-N 218.190 0.424 5 40 BCBB NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 5816317 KVONKVDBPZPOLA-UHFFFAOYSA-N 225.160 0.531 5 40 BCBB Nc1cc([N+](=O)[O-])ccc1S(=O)(=O)O 1670003 YMJXNYUOEJPKHH-UHFFFAOYSA-N 218.190 0.424 5 40 BCBB C[C@@]1(O)CC[C@@H](O)C[C@@H]1CC[N+](C)(C)[O-] 5495689 OYIIBRVYRBWAJY-HBNTYKKESA-N 217.309 0.863 5 40 BCBB O=[N+]([O-])c1cc(O)cc(S(=O)(=O)O)c1 12846530 NPGPMHKPZAMEHP-UHFFFAOYSA-N 219.174 0.547 5 40 BCBB CN1C(=O)C=C(Nc2cccc([N+](=O)[O-])c2)C1=O 11613075 YTDVTGWVCHRQFZ-UHFFFAOYSA-N 247.210 0.889 5 40 BCBB Cc1c([N+](=O)[O-])cnn1CCC(=O)NC1CC1 2805066 PYBNUHRCVMGWPL-UHFFFAOYSA-N 238.247 0.768 5 40 BCBB O=c1[nH]c2c(=O)[nH]c3ccccc3c2[nH]c1=O 72416404 OYMVPEKRAVUGQR-UHFFFAOYSA-N 229.195 0.058 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c2nnn(C)c2c1 218257822 BPOMUECXSMEZCD-UHFFFAOYSA-N 236.187 0.663 5 40 BCBB O=C(O)Cn1cc(-n2cc([N+](=O)[O-])cn2)cn1 685936666 OROUGESQHXCGDV-UHFFFAOYSA-N 237.175 0.062 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)C(O)=NS2(=O)=O 1585150 KABUZPWVPGUDIR-UHFFFAOYSA-N 228.185 0.602 5 40 BCBB biogenic,in-vitro Cc1nc([N+](=O)[O-])cn1CC(=O)NC(C)C 49446100 HELYRFWVMBDDMA-UHFFFAOYSA-N 226.236 0.624 5 40 BCBB O=C(NCCO)Nc1ccc([N+](=O)[O-])cc1 5398618 CTLLVOJBVPFXHJ-UHFFFAOYSA-N 225.204 0.709 5 40 BCBB CCNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O 15206940 ICBGAFYZVLTEAC-UHFFFAOYSA-N 245.260 0.674 5 40 BCBB in-vitro Cc1nn(C)c(N2CCN(C)CC2)c1[N+](=O)[O-] 32934502 FUHXFJAJHYQYFQ-UHFFFAOYSA-N 239.279 0.389 5 40 BCBB O=C1C[C@H](n2cc([N+](=O)[O-])cn2)[C@H]2CO[C@@H]1O2 14987695 RHTZTGMVZGRMHG-NBEYISGCSA-N 239.187 0.047 5 40 BCBB CO[C@H]1CC[C@H](O)[C@H](/C=C/[N+](=O)[O-])C1 5733824 QYXZOFLIRWHLBP-HKMLNRKSSA-N 201.222 0.953 5 40 BCBB O=[N+]([O-])c1ccccc1Cc1nnn[nH]1 20077631 QTFPZDIGKYZDMI-UHFFFAOYSA-N 205.177 0.699 5 40 BCBB in-vitro O=C1NCCN1C(=O)c1ccc([N+](=O)[O-])cc1 39417655 IYSLHQBLAXOBCI-UHFFFAOYSA-N 235.199 0.760 5 40 BCBB Cc1nc([N+](=O)[O-])c2n1C[C@H](O)CS2 346360 DFJODVNWQIWHEB-YFKPBYRVSA-N 215.234 0.566 5 40 BCBB Cc1nc(N2CCOCC2)nc(O)c1[N+](=O)[O-] 9348503 WABIDMYEKCIEKQ-UHFFFAOYSA-N 240.219 0.235 5 40 BCBB O=c1[nH]c2cc(F)c([N+](=O)[O-])cc2[nH]c1=O 34062426 MSVAVCLZHVHHLY-UHFFFAOYSA-N 225.135 0.264 5 40 BCBB CCN1CC[C@H]2C[N+](C)([O-])CCN2C1=O 1730375 WQQQYUBVAILWQW-LLTODGECSA-N 213.281 0.461 5 40 BCBB CON[S@@](=O)c1ccc([N+](=O)[O-])cc1 6385487 QZBYTLBYMFVRBZ-CQSZACIVSA-N 216.218 0.768 5 40 BCBB O=C(OCc1ccno1)[C@@H]1C[C@@H]1[N+](=O)[O-] 89885093 JOJLCHDWKQIRJJ-RQJHMYQMSA-N 212.161 0.383 5 40 BCBB NC(=O)CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 3845789 QMHIOEYRHBAHBW-UHFFFAOYSA-N 239.187 0.921 5 40 BCBB biogenic COC(=O)[C@@H]1[C@H](O)C[C@@H]2CC[C@H]1[N+]2(C)C 5015078 PRTGVCOFANEHJQ-JLIMGVALSA-N 214.285 0.148 5 40 BCBB CC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 4434079 BNXIXBYEWWDXOU-UHFFFAOYSA-N 248.194 0.780 5 40 BCBB O=C(NCc1nccs1)[C@H]1C[C@H]1[N+](=O)[O-] 65474649 KJAOTAPNEOTDFY-NTSWFWBYSA-N 227.245 0.425 5 40 BCBB CCOC(=O)c1c([N+](=O)[O-])c(C(=O)O)nn1C 39321004 JGMDTPHPXVIHLK-UHFFFAOYSA-N 243.175 0.203 5 40 BCBB Nc1nnc2ccc3ccccc3c2[n+]1[O-] 225621709 OKFCLASXBLYOHH-UHFFFAOYSA-N 212.212 0.999 5 40 BCBB O=c1nc2cc(F)c([N+](=O)[O-])cc2c[nH]1 80810210 QTWWHMCOMVAYJI-UHFFFAOYSA-N 209.136 0.970 5 40 BCBB NS(=O)(=O)c1cc([N+](=O)[O-])cs1 59405286 RHRBWSCTTUHORC-UHFFFAOYSA-N 208.220 0.304 5 40 BCBB in-vitro O=Cc1cc(OCC(=O)O)ccc1[N+](=O)[O-] 2513216 LNLRSVVPVPSANB-UHFFFAOYSA-N 225.156 0.871 5 40 BCBB NNc1ncnc2ccc([N+](=O)[O-])cc12 14162637 DGMHBMHKGKPAGA-UHFFFAOYSA-N 205.177 0.824 5 40 BCBB Cc1ccc([N+](=O)[O-])cc1NCC(N)=O 9157683 YXARJFDLVGSPIW-UHFFFAOYSA-N 209.205 0.800 5 40 BCBB C[C@@](N)(C(=O)O)c1cccc([N+](=O)[O-])c1 41598327 XZQJKUIVACLBNX-VIFPVBQESA-N 210.189 0.853 5 40 BCBB in-vitro N[C@@H](C(=O)O)[C@H](O)c1ccc([N+](=O)[O-])cc1 518960 MDMLHLZJIBYSKV-HTQZYQBOSA-N 226.188 0.040 5 40 BCBB biogenic CCNC(=O)c1cc([N+](=O)[O-])ccc1N 50211307 DDMSDKCJYLXYLM-UHFFFAOYSA-N 209.205 0.927 5 40 BCBB O=[N+]([O-])C[C@@H](O)c1cccc([N+](=O)[O-])c1 59186185 IBFRLMGYDNNEOC-MRVPVSSYSA-N 212.161 0.905 5 40 BCBB O=C(NCc1nccs1)[C@H]1C[C@@H]1[N+](=O)[O-] 65474647 KJAOTAPNEOTDFY-WDSKDSINSA-N 227.245 0.425 5 40 BCBB O=c1[nH]nc(CNc2ccc([N+](=O)[O-])cn2)[nH]1 89794290 KFDJIWDXCCDWQU-UHFFFAOYSA-N 236.191 0.013 5 40 BCBB Cn1ncc([N+](=O)[O-])c1-c1nnc(N)s1 408717769 SWOZTHZTXZPKIO-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 1689109 FWIZOFDVGZCRTB-UHFFFAOYSA-N 206.157 0.821 5 40 BCBB CO[C@]1(C[N+](=O)[O-])OC(=O)c2ccccc21 77065 RSAZKHRUKRPGJB-SNVBAGLBSA-N 223.184 0.933 5 40 BCBB Cn1cc([N+](=O)[O-])c(SCC(=O)O)n1 95098619 KKOGVWJVSNEINW-UHFFFAOYSA-N 217.206 0.505 5 40 BCBB O=[N+]([O-])c1cccnc1N[C@H]1CCNC1 52093909 MLDNPNZRJOFIEZ-ZETCQYMHSA-N 208.221 0.764 5 40 BCBB NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 38342031 QFLHYQTVLJRGME-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB in-vitro CCN(CC)CCn1cnc([N+](=O)[O-])n1 97058013 CEFUSFZALZKBCJ-UHFFFAOYSA-N 213.241 0.528 5 40 BCBB CC(C)(CO)Nc1ncnc(N)c1[N+](=O)[O-] 3912498 VDLNEVWQIZSTLS-UHFFFAOYSA-N 227.224 0.150 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c2c(c1)no[n+]2[O-] 4729070 AXOSTNNBSAMGLA-UHFFFAOYSA-N 226.104 0.278 5 40 BCBB O=c1c([N+](=O)[O-])ccc2n1C[C@H]1CNC[C@@H]2C1 88385631 TYIJTKJEBUZNGQ-SFYZADRCSA-N 235.243 0.463 5 40 BCBB biogenic O=[N+]([O-])C1=C[C@H]2NSN[C@@H]2c2nsnc21 5382416 OXLXAZUXEVCWBI-FONMRSAGSA-N 243.273 0.335 5 40 BCBB N[C@H](C(=O)O)c1cc(O)ccc1[N+](=O)[O-] 72196194 KFLILFZNCXDXLR-ZETCQYMHSA-N 212.161 0.385 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])ccc1P(=O)(O)O 1870301 MCPOAUOJYJEJLX-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB CCn1cc([N+](=O)[O-])c(C(=O)n2cccn2)n1 2767372 SSFAWMUKOPJBBH-UHFFFAOYSA-N 235.203 0.696 5 40 BCBB COC(=O)c1ccc(N)c(O)c1[N+](=O)[O-] 147279843 YMDUWJSHJHNAHC-UHFFFAOYSA-N 212.161 0.669 5 40 BCBB O=[N+]([O-])c1ccc2[nH][n+](=O)nc(O)c2c1 363413256 ZOEZNELPWBRGDV-UHFFFAOYSA-O 209.141 0.091 5 40 BCBB Nc1nc(NN2CCCCC2)ncc1[N+](=O)[O-] 95349002 FQUFJTSDYIGMPU-UHFFFAOYSA-N 238.251 0.780 5 40 BCBB CC(=O)Nc1ccc(NN)c([N+](=O)[O-])c1 15020251 PQRKIJZIYQXVHB-UHFFFAOYSA-N 210.193 0.839 5 40 BCBB C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)O 85282 CBMCTOCBSFJMEG-LURJTMIESA-N 238.199 0.798 5 40 BCBB Cc1nc(CS(C)(=O)=O)c([N+](=O)[O-])n1C 96532817 ZYQZMXYVMXPJBB-UHFFFAOYSA-N 233.249 0.181 5 40 BCBB CC(C)NC(=O)c1c([N+](=O)[O-])ncn1C 13212539 USHZAQTWSQLZKQ-UHFFFAOYSA-N 212.209 0.467 5 40 BCBB COc1coc([C@@H](O)[C@@H](C)[N+](=O)[O-])cc1=O 480706 VLNFWBYJEHFZAB-ANLVUFKYSA-N 229.188 0.347 5 40 BCBB O=c1nc2oc3ccccc3cc-2c(=O)[nH]1 1280587 BFMCRAXOACCPEL-UHFFFAOYSA-N 214.180 0.981 5 40 BCBB in-vivo CN(C)C[C@@H](O)COc1ccc([N+](=O)[O-])cc1 4917623 PCCRZPIJPREQTI-SNVBAGLBSA-N 240.259 0.896 5 40 BCBB O=[N+]([O-])c1ncn(Cc2cccnc2)n1 48603260 ALXKVWKEOLNRCJ-UHFFFAOYSA-N 205.177 0.630 5 40 BCBB O=[N+]([O-])c1ccc(CO)cc1N1CC[C@@H](O)C1 95993846 QITSXFCBYKKPBY-SECBINFHSA-N 238.243 0.658 5 40 BCBB C[C@@H](O)[C@@H]([N+](=O)[O-])[C@@](C)(O)Br 2559129 MQHAOXSTVZHBGN-UOWFLXDJSA-N 228.042 0.116 5 40 BCBB Cc1c(Cl)[nH]c(=O)c([N+](=O)[O-])c1O 71255555 ZWIROQNFPPQVBG-UHFFFAOYSA-N 204.569 0.951 5 40 BCBB N[C@H](C(=O)O)[C@@H](O)c1ccc([N+](=O)[O-])cc1 518957 MDMLHLZJIBYSKV-YUMQZZPRSA-N 226.188 0.040 5 40 BCBB biogenic NS(=O)(=O)c1cccc([N+](=O)[O-])c1F 116883856 KQPBLNSGJJFTDN-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB O=[N+]([O-])c1cccnc1N1CCC[C@@H]1CO 42434650 YBIZHYVHQBRYBD-MRVPVSSYSA-N 223.232 0.951 5 40 BCBB CCCNC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1 97048029 XPQIIILGRSKMBM-SSDOTTSWSA-N 226.236 0.879 5 40 BCBB O=[N+]([O-])c1c(F)cccc1NC(CO)CO 83694450 MKIJJSNQDJNOPL-UHFFFAOYSA-N 230.195 0.499 5 40 BCBB O=C(c1ccc([N+](=O)[O-])o1)N1CCCO1 97083462 RCJAZULCUDZNJL-UHFFFAOYSA-N 212.161 0.965 5 40 BCBB O=[N+]([O-])c1c(N2CC[C@H](O)C2)nc2ccccn12 69491424 IUYARNHPLKISSI-QMMMGPOBSA-N 248.242 0.814 5 40 BCBB O=C1OCCN1Nc1ccc([N+](=O)[O-])cn1 4419348 ZMDVJZJQRGVHQU-UHFFFAOYSA-N 224.176 0.769 5 40 BCBB CCOC(=O)c1nc([N+](=O)[O-])cn1CC 39101687 VVRYUYMABGDVQT-UHFFFAOYSA-N 213.193 0.988 5 40 BCBB NC(=O)c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1 95829410 CZJXPRIRONCXCN-UHFFFAOYSA-N 211.133 0.602 5 40 BCBB Cc1ncc([N+](=O)[O-])n1CCOC(N)=O 1481981 JOVXEDBYAWFQQX-UHFFFAOYSA-N 214.181 0.195 5 40 BCBB in-man COC(=O)Cn1c(C)c([N+](=O)[O-])ccc1=O 71526561 RFTOAXGJKFQBLB-UHFFFAOYSA-N 226.188 0.238 5 40 BCBB CCOC(=O)c1cnc(N)c([N+](=O)[O-])c1 79006923 SAOCMXIYAPVORO-UHFFFAOYSA-N 211.177 0.749 5 40 BCBB O=C1C[C@H](Oc2ccc([N+](=O)[O-])cc2)N1 34215164 FZKCDUYSEXXUPD-VIFPVBQESA-N 208.173 0.820 5 40 BCBB in-vitro O=c1[nH]c(O)nc2cccc([N+](=O)[O-])c12 91301417 UHAHRTQKXUKYDY-UHFFFAOYSA-N 207.145 0.537 5 40 BCBB CC(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1 1570210 HYBXLDUPXUPJQQ-JTQLQIEISA-N 224.216 0.764 5 40 BCBB C[C@@]1(O)CC[C@H](O)C[C@@H]1CC[N+](C)(C)[O-] 1581092 OYIIBRVYRBWAJY-GARJFASQSA-N 217.309 0.863 5 40 BCBB CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1OC 32401684 GFCFEXRMUPEKNB-UHFFFAOYSA-N 246.244 0.512 5 40 BCBB CN(Cc1ccc([N+](=O)[O-])cc1)C(=O)CN 79420821 VPTGOJDJEPLSCJ-UHFFFAOYSA-N 223.232 0.512 5 40 BCBB O=c1[nH]nc2nc3[nH]c4ccccc4c3nn12 226795939 PMPYHABNZLTXAC-UHFFFAOYSA-N 226.199 0.447 5 40 BCBB Cn1cc([N+](=O)[O-])c(-c2nnc(N)s2)n1 408717592 JKUJKWPXVWQING-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB C[C@@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 75582056 YHCHFSQVGTWSIE-ZCFIWIBFSA-N 223.236 0.813 5 40 BCBB CSc1nc(C)c([N+](=O)[O-])c(N)n1 4429584 POQACVFFIQRRIF-UHFFFAOYSA-N 200.223 0.997 5 40 BCBB CNC(=S)Nc1ccc([N+](=O)[O-])cn1 13838270 RLRFSFGFCMBKGL-UHFFFAOYSA-N 212.234 0.906 5 40 BCBB O=[N+]([O-])c1ccn(CCC2OCCCO2)n1 67800423 RGLFJMYDQJRZQR-UHFFFAOYSA-N 227.220 0.944 5 40 BCBB C[C@@H](O)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 96429751 XCAKHCPFZQITSA-ZCFIWIBFSA-N 241.251 0.174 5 40 BCBB COC(=O)c1cc(OC)c(N)c([N+](=O)[O-])c1 199822788 YAONCULDIBQWOJ-UHFFFAOYSA-N 226.188 0.972 5 40 BCBB NC[C@H](C(=O)O)c1ccc([N+](=O)[O-])cc1 44196533 KABVBULYAZTSON-QMMMGPOBSA-N 210.189 0.722 5 40 BCBB Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NN 6079023 KXDLQNGMGFULGI-UHFFFAOYSA-N 231.233 0.055 5 40 BCBB COC(=O)Cn1ccc(C)c([N+](=O)[O-])c1=O 89700620 RAZPBEAYQIFNHD-UHFFFAOYSA-N 226.188 0.238 5 40 BCBB CCOC(=O)CNc1ncccc1[N+](=O)[O-] 34215867 JWMHRAUUHFSEJO-UHFFFAOYSA-N 225.204 0.965 5 40 BCBB O=[N+]([O-])c1cccnc1N[C@@H]1CCNC1 52093908 MLDNPNZRJOFIEZ-SSDOTTSWSA-N 208.221 0.764 5 40 BCBB O=C1NC(=O)/C(=C/c2ccc([N+](=O)[O-])o2)N1 5582051 QFWCTABYNWDQLY-HYXAFXHYSA-N 223.144 0.368 5 40 BCBB O=[N+]([O-])c1cccc(OC[C@@H](O)CO)c1 6092502 HJYXCTLKGAOVHQ-QMMMGPOBSA-N 213.189 0.327 5 40 BCBB O=[N+]([O-])c1cnc(N2CCC[C@H](O)C2)nc1 40455014 AKQVFOYTNARRNP-QMMMGPOBSA-N 224.220 0.346 5 40 BCBB OCC[N+]12CCN(CC1)c1ccccc12 3096934 YMNAXNZYJRKYCD-UHFFFAOYSA-N 205.281 0.820 5 40 BCBB COC(=O)c1ccc([C@H](O)C[N+](=O)[O-])cc1 1396178 LNECTYJAMWFQHJ-SECBINFHSA-N 225.200 0.783 5 40 BCBB NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 2508558 PFUIPMAPEJSGLA-UHFFFAOYSA-N 233.187 0.274 5 40 BCBB O=[N+]([O-])c1cnn(CCC2OCCO2)c1 67796666 SLPJGDCIJSBQAU-UHFFFAOYSA-N 213.193 0.554 5 40 BCBB CO[C@H]([C@@H](OC)[N+](C)(C)C)[N+](C)(C)C 3843383 PNXZJSVFTBMPKF-NXEZZACHSA-N 206.330 0.344 5 40 BCBB CN(C)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1 5912350 WGJTUYUQUADIKL-UHFFFAOYSA-N 237.215 0.622 5 40 BCBB O=[N+]([O-])c1cccc2nn([N+](=O)[O-])cc12 5648960 JKOIVXNMQFEXHU-UHFFFAOYSA-N 208.133 0.984 5 40 BCBB O=C(O)c1ccn(Cn2ccc([N+](=O)[O-])n2)n1 2535146 JHYYSBLEENHQRS-UHFFFAOYSA-N 237.175 0.192 5 40 BCBB Cc1nn2c(NN)nc3ccccc3c2nc1=O 32934921 GIZQHFCSHBXQLL-UHFFFAOYSA-N 242.242 0.232 5 40 BCBB O=Cc1ccc(OCC(=O)O)c([N+](=O)[O-])c1 20198604 TXWVISSJNXSOQX-UHFFFAOYSA-N 225.156 0.871 5 40 BCBB in-vitro O=[N+]([O-])c1ccc(CNn2cnnc2)cc1 7601134 IIAFWTBGKJKBLT-UHFFFAOYSA-N 219.204 0.930 5 40 BCBB CN(CCO)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 7976092 SAKOGKSFCYSFQW-UHFFFAOYSA-N 241.203 0.932 5 40 BCBB CNc1nc(N2CCCC2)nc(N)c1[N+](=O)[O-] 4140230 RDZCBJLCOSWIKX-UHFFFAOYSA-N 238.251 0.609 5 40 BCBB Cn1c(NCC[N+](C)(C)C)nc2ncncc21 1717607 HRMVVGSURFVAJK-UHFFFAOYSA-N 235.315 0.481 5 40 BCBB C[C@H](O)CNc1ccc([N+](=O)[O-])c(N)c1 5275219 ZVSXXPZMBODAOZ-LURJTMIESA-N 211.221 0.970 5 40 BCBB O=[N+]([O-])c1ccc([C@H](O)S(=O)(=O)O)cc1 5945046 WRSIQYIEVOPSQZ-SSDOTTSWSA-N 233.201 0.474 5 40 BCBB O=[N+]([O-])c1ccc(-n2cc(CO)nn2)nc1 9950628 PFPREAMUTHQHQL-UHFFFAOYSA-N 221.176 0.063 5 40 BCBB CN(C)C(=O)OCCn1cnc([N+](=O)[O-])c1 130363165 UFBZYGYSTBRJGS-UHFFFAOYSA-N 228.208 0.490 5 40 BCBB C[C@H](CC(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918722 DKLNSKLAIZTYMP-SCSAIBSYSA-N 244.163 0.735 5 40 BCBB Cc1nn(CCC(N)=O)c(C)c1[N+](=O)[O-] 8726484 PMNSZURQWUBTHE-UHFFFAOYSA-N 212.209 0.284 5 40 BCBB CCN1CCN(c2c([N+](=O)[O-])ncn2C)CC1 9338241 SIAZDHYBTOKHOR-UHFFFAOYSA-N 239.279 0.470 5 40 BCBB Cc1nn(C)c(N2CCC[C@@H](O)C2)c1[N+](=O)[O-] 40437193 RUUWIYYAXPUJOP-MRVPVSSYSA-N 240.263 0.598 5 40 BCBB CCCN(C)c1ncc([N+](=O)[O-])c(N)n1 63737372 AWKMHNOGMFYZCG-UHFFFAOYSA-N 211.225 0.813 5 40 BCBB C[N+](C)(C)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 17323838 ASNGCLKEZFFCDA-PHIMTYICSA-N 239.339 0.868 5 40 BCBB O=c1cc(O)c2c(ccc3c(O)cc(=O)[nH]c32)[nH]1 6423876 SYNUURCFUWWCPC-UHFFFAOYSA-N 244.206 0.781 5 40 BCBB O=C1NC(=O)/C(=C\c2cc([N+](=O)[O-])ccc2O)N1 37263590 FBRBRBZQTHISBU-QPJJXVBHSA-N 249.182 0.481 5 40 BCBB Cn1c(=O)c([N+](=O)[O-])cc2cccnc21 242722846 XWYQNWHJMLVJEC-UHFFFAOYSA-N 205.173 0.842 5 40 BCBB COc1ccc2oc3nc(=O)[nH]c(=O)c-3cc2c1 3159503 BJSLLSAUOUBQJV-UHFFFAOYSA-N 244.206 0.990 5 40 BCBB O=[N+]([O-])c1ccc(-n2cnnc2)c(O)c1 66111174 WXRIVVWFEYIVGB-UHFFFAOYSA-N 206.161 0.881 5 40 BCBB O=[N+]([O-])c1ccc(N2CCNCC2)cc1O 4687283 XISMTXAQJGWFHU-UHFFFAOYSA-N 223.232 0.710 5 40 BCBB CNC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 32814997 WAMJZYLPHCHITH-UHFFFAOYSA-N 238.199 0.726 5 40 BCBB O=C(O)CCNC(=O)c1ccc([N+](=O)[O-])o1 2647822 UBFCXBILQZHHCN-UHFFFAOYSA-N 228.160 0.392 5 40 BCBB in-vitro O=[N+]([O-])c1cc(CO)ccc1OCCO 2529187 XFNNYCZPIGWQOE-UHFFFAOYSA-N 213.189 0.458 5 40 BCBB Cc1cc2[nH]c(=O)c(=O)[nH]c2c([N+](=O)[O-])c1C 6308 CYJRVSOLVYLORV-UHFFFAOYSA-N 235.199 0.741 5 40 BCBB COc1cc([N+](=O)[O-])cc2c1NC(=O)C2=O 19401703 JPWXJPFTGAZICX-UHFFFAOYSA-N 222.156 0.738 5 40 BCBB Cc1nc([N+](=O)[O-])c(SCC(=O)O)[nH]1 8743675 ODNCFZQUNCXZEA-UHFFFAOYSA-N 217.206 0.803 5 40 BCBB Cn1c([N+](=O)[O-])cnc1-c1nnc(N)s1 17061909 VDZZTXBMKRQEPO-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB O=C(O)CCNC(=O)c1cccc([N+](=O)[O-])c1 20205463 HJXNWCCCIXFBND-UHFFFAOYSA-N 238.199 0.799 5 40 BCBB O=C1Nc2ccccc2[C@]1(O)C[N+](=O)[O-] 503912 LXHQTPGTMXKWEY-SECBINFHSA-N 208.173 0.103 5 40 BCBB C[C@@H](CC(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918721 DKLNSKLAIZTYMP-BYPYZUCNSA-N 244.163 0.735 5 40 BCBB C[C@H]1CN(c2ncccc2[N+](=O)[O-])CCN1 15443724 JRVIFHPFNSWJLO-QMMMGPOBSA-N 222.248 0.788 5 40 BCBB O=C(O)Cc1cc2c(cc1[N+](=O)[O-])OCCO2 62152932 YXBNHCODFVRXJK-UHFFFAOYSA-N 239.183 0.993 5 40 BCBB in-vitro O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1CCO 342803 WQVLISNHYKCNPD-UHFFFAOYSA-N 236.183 0.183 5 40 BCBB O=[N+]([O-])c1cccc(OC[C@@H]2CNCCO2)c1 80760362 RNYZSTAAKUCYPH-NSHDSACASA-N 238.243 0.962 5 40 BCBB C[C@H](O)CCN(C)c1ncc([N+](=O)[O-])c(N)n1 96429750 XCAKHCPFZQITSA-LURJTMIESA-N 241.251 0.174 5 40 BCBB C[N+]1([C@H]2C[C@@H]3CC[C@@H]2C3=O)CCOCC1 104098359 ZYOJMOBGJMTZFJ-DCAQKATOSA-N 210.297 0.831 5 40 BCBB COc1ccc(NS(C)(=O)=O)c([N+](=O)[O-])c1 4371745 KKILLYGTLSJTBU-UHFFFAOYSA-N 246.244 0.975 5 40 BCBB O=C1CCN[C@@H](c2cccc([N+](=O)[O-])c2)N1 206544289 VKUFEMWAMQZKDT-SNVBAGLBSA-N 221.216 0.703 5 40 BCBB COC(=O)[C@H](C)Oc1cccnc1[N+](=O)[O-] 47874052 XTIRYUVBVZEHLG-LURJTMIESA-N 226.188 0.930 5 40 BCBB O=C1NC(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)N1 73083 MSTWOYMTYLWAGQ-VMPITWQZSA-N 233.183 0.775 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])cc(P(=O)(O)O)c1 1726096 JEBYQEOUNSVSMV-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB Cc1nc(SCCO)c([N+](=O)[O-])[nH]1 5690848 RGEJMIIHSCQDDX-UHFFFAOYSA-N 203.223 0.711 5 40 BCBB O=[N+]([O-])c1c[nH]nc1I 95930396 AHUVQFQJTKBFOI-UHFFFAOYSA-N 238.972 0.923 5 40 BCBB COC(=O)c1cc(C(N)=O)cc([N+](=O)[O-])c1 3163560 FUXUMOOJLAEGAX-UHFFFAOYSA-N 224.172 0.480 5 40 BCBB CS(=O)(=O)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 95095243 JWHMTLPMBPXJOP-SECBINFHSA-N 245.256 0.673 5 40 BCBB N[C@@H](C(=O)O)c1cc(O)ccc1[N+](=O)[O-] 199810664 KFLILFZNCXDXLR-SSDOTTSWSA-N 212.161 0.385 5 40 BCBB O=C(O)Cc1cc(C(=O)O)ccc1[N+](=O)[O-] 2526747 AZEOSFLCWVMKLE-UHFFFAOYSA-N 225.156 0.920 5 40 BCBB NCC(=S)n1nnc2ccc([N+](=O)[O-])cc21 75629723 UJQZVSPRRUITEG-UHFFFAOYSA-N 237.244 0.474 5 40 BCBB COc1ccc(Cn2nnnc2C)cc1[N+](=O)[O-] 339067 JGHKFVSBGWLHSD-UHFFFAOYSA-N 249.230 0.947 5 40 BCBB O=[N+]([O-])c1ccc([C@H](O)Cn2cncn2)cc1 5570051 JBQIUUDXTWMFAA-SNVBAGLBSA-N 234.215 0.920 5 40 BCBB N[C@@H](C(=O)O)c1ccc(O)c([N+](=O)[O-])c1 95931944 WPJSXUYBLQGKHR-SSDOTTSWSA-N 212.161 0.385 5 40 BCBB Cn1c(=O)c(=O)n(C)c2nc3ccccc3nc21 1717159 HTKSUTVGZWBQRB-UHFFFAOYSA-N 242.238 0.180 5 40 BCBB CCOC(=O)[C@@H](CC)[C@@](C)(O)C[N+](=O)[O-] 5468469 POFPSRKAOLOFKX-APPZFPTMSA-N 219.237 0.603 5 40 BCBB O=C(NO[C@@H]1CCCCO1)[C@@H]1C[C@@H]1[N+](=O)[O-] 58423587 CDOUWDMTGNDIRM-GJMOJQLCSA-N 230.220 0.226 5 40 BCBB COC1=NC(CC(C)=O)N=C(OC)C1[N+](=O)[O-] 100926305 VAODSQOJHIILIU-UHFFFAOYSA-N 243.219 0.040 5 40 BCBB C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O 5840774 CDBXKLYOJGRINM-LURJTMIESA-N 238.199 0.798 5 40 BCBB in-vitro CC(C)N(CCO)c1ncc([N+](=O)[O-])cn1 40455021 YUTLVGWAMLJFNW-UHFFFAOYSA-N 226.236 0.592 5 40 BCBB C[N+](C)(C)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 104388113 ASNGCLKEZFFCDA-GHMZBOCLSA-N 239.339 0.868 5 40 BCBB NCCc1ccc(CCN)c([N+](=O)[O-])c1 3845287 OCJQBWLSAPYSRA-UHFFFAOYSA-N 209.249 0.597 5 40 BCBB biogenic Cn1ccnc1[C@@](O)(C[N+](=O)[O-])C(F)(F)F 40556073 ASRYJDZWHVCMFE-LURJTMIESA-N 239.153 0.447 5 40 BCBB CCN1CC[C@@H]2C[N+](C)([O-])CCN2C1=O 1730377 WQQQYUBVAILWQW-CGCSKFHYSA-N 213.281 0.461 5 40 BCBB Cn1c(=O)[nH]c2nc3ccccc3nc2c1=O 6534008 YUZCNGXOZXEJJS-UHFFFAOYSA-N 228.211 0.170 5 40 BCBB CCOCCn1cccc([N+](=O)[O-])c1=O 75582320 KTWYQJZCLDEZMK-UHFFFAOYSA-N 212.205 0.793 5 40 BCBB CC1([N+](=O)[O-])COP(=O)(N2CC2)OC1 4934175 OVSMZRJGZOZYFR-UHFFFAOYSA-N 222.137 0.492 5 40 BCBB NC(=O)c1cccc(Cn2cc([N+](=O)[O-])cn2)c1 32827072 GVULJHMOFNWJFB-UHFFFAOYSA-N 246.226 0.939 5 40 BCBB COC(=O)[C@@H]1[C@H](O)C[C@H]2CC[C@H]1[N+]2(C)C 104095928 PRTGVCOFANEHJQ-KYXWUPHJSA-N 214.285 0.148 5 40 BCBB COc1cccc([N+](=O)[O-])c1S(N)(=O)=O 115303340 XBJCOCHOLDKOLN-UHFFFAOYSA-N 232.217 0.251 5 40 BCBB CNC(=S)NNc1ccc([N+](=O)[O-])cn1 20031057 NFGWMBQWELBEIE-UHFFFAOYSA-N 227.249 0.411 5 40 BCBB NNc1ccc([N+](=O)[O-])cc1S(=O)(=O)O 146076385 IVCCIESFHBWZBA-UHFFFAOYSA-N 233.205 0.127 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])n(C(F)F)n1 408715752 DERWUKGERQBNDX-UHFFFAOYSA-N 207.092 0.885 5 40 BCBB C[N+](C)(C)CCCN1C(=O)CCCC1=O 1824652 XLPBGKXXHFEANS-UHFFFAOYSA-N 213.301 0.622 5 40 BCBB c1cc(C[N+]23CN4CN(CN(C4)C2)C3)cs1 19323807 WHHZLDHKDYHMPO-UHFFFAOYSA-N 237.352 0.757 5 40 BCBB Cn1nc([N+](=O)[O-])cc1-c1nnc(N)s1 408717487 CKKPKFROJZMPRE-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB NC(=O)CSc1ccc([N+](=O)[O-])cn1 6756670 WJRPKLJSHAJQBI-UHFFFAOYSA-N 213.218 0.567 5 40 BCBB CO[C@@H]1[C@H](OC)[C@H]2CC(=O)C[C@H]1[N+]2(C)C 104100516 HWLHUCCBZFCIKY-DBIOUOCHSA-N 214.285 0.207 5 40 BCBB O=C1N[C@H](O)c2cccc([N+](=O)[O-])c2O1 1579863 QWLTXKMLYXNKQL-SSDOTTSWSA-N 210.145 0.688 5 40 BCBB O=[N+]([O-])C1=C[C@@H]2NSN[C@@H]2c2nsnc21 5382417 OXLXAZUXEVCWBI-OKKQSCSOSA-N 243.273 0.335 5 40 BCBB NC(=O)COc1ccc([N+](=O)[O-])cc1C=O 16754172 DHYMPTCHPJNVEQ-UHFFFAOYSA-N 224.172 0.271 5 40 BCBB CCOC(=O)C[C@H](C(=O)OCC)[C@H](C)[N+](=O)[O-] 32911433 GVCIHMUGJCWCKR-YUMQZZPRSA-N 247.247 0.784 5 40 BCBB CNC(=S)/N=c1\sc([N+](=O)[O-])c(C)n1C 104266196 PTLGTXOVAXIOIN-CLFYSBASSA-N 246.317 0.708 5 40 BCBB O=[N+]([O-])c1ccc(-n2cnnn2)c(O)c1 2248513 OEXFBTKZKUNNAC-UHFFFAOYSA-N 207.149 0.276 5 40 BCBB Cc1n[nH]c(NCCC(=O)O)c1[N+](=O)[O-] 6300100 GIAXDAKDZMZDOP-UHFFFAOYSA-N 214.181 0.513 5 40 BCBB Nc1nc(NCc2ccccn2)ncc1[N+](=O)[O-] 71286698 RSZKCTKWHDQWNC-UHFFFAOYSA-N 246.230 0.974 5 40 BCBB Cc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1 258054 HMHJPNRCHAPXDB-UHFFFAOYSA-N 216.218 0.551 5 40 BCBB O=C(O)c1cn2cc([N+](=O)[O-])ccc2n1 3742149 DMZAUINNDYXDKV-UHFFFAOYSA-N 207.145 0.941 5 40 BCBB CCOC(=O)c1ncc([N+](=O)[O-])n1CC 39101686 DKFMSVHCQMMXOA-UHFFFAOYSA-N 213.193 0.988 5 40 BCBB CNS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] 35322457 UFJJCHUOKLCVJN-UHFFFAOYSA-N 230.245 0.811 5 40 BCBB CN1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 36756040 GMETUHFKFADYGW-UHFFFAOYSA-N 235.199 0.993 5 40 BCBB CO[C@H]1[C@@H]2CC(=O)C[C@@H]([C@H]1OC)[N+]2(C)C 104100530 HWLHUCCBZFCIKY-XWLWVQCSSA-N 214.285 0.207 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)OC[C@@H](CO)O2 39276719 QSRIKCXVBZGOJP-SSDOTTSWSA-N 211.173 0.727 5 40 BCBB O=C(Cn1cncn1)Nc1ccc([N+](=O)[O-])cc1 5937987 RSAMJDMTIUJTDU-UHFFFAOYSA-N 247.214 0.825 5 40 BCBB Cn1cnnc1SCn1cc([N+](=O)[O-])cn1 16972397 HJHQTMRRZRGYPZ-UHFFFAOYSA-N 240.248 0.670 5 40 BCBB O=C(O)c1cccc(Cn2cnc([N+](=O)[O-])n2)c1 335381 PBPBRUBGUQMZBF-UHFFFAOYSA-N 248.198 0.933 5 40 BCBB O=C1CN(C(=O)c2cccc([N+](=O)[O-])c2)CCN1 23419329 LHOWKABUGQYJIR-UHFFFAOYSA-N 249.226 0.167 5 40 BCBB NC(=O)c1nc(Cl)ccc1[N+](=O)[O-] 38996826 SZUHUTYSEVDKJJ-UHFFFAOYSA-N 201.569 0.742 5 40 BCBB in-vitro O=[N+]([O-])c1cccnc1N1CC[C@@H](CO)C1 51886292 BOLXNEAVLLPMDD-MRVPVSSYSA-N 223.232 0.808 5 40 BCBB O=[N+]([O-])c1ccccc1OC[C@@H](O)CO 59355115 VYYIKGCZHKHONW-ZETCQYMHSA-N 213.189 0.327 5 40 BCBB COC(C)(Cn1ccc([N+](=O)[O-])n1)OC 67802997 SEFPZFKGHGDFOU-UHFFFAOYSA-N 215.209 0.800 5 40 BCBB CCN(CC)C(=O)c1cc([N+](=O)[O-])nn1C 72334116 NJLGSQNOSWQTQS-UHFFFAOYSA-N 226.236 0.810 5 40 BCBB Nc1cc(NCCNCCO)ccc1[N+](=O)[O-] 4045574 HMVINGWCMHVCCK-UHFFFAOYSA-N 240.263 0.171 5 40 BCBB O=C(O)c1cnnn1-c1ccc([N+](=O)[O-])cc1 49826186 VMSDGQNKTGSGQA-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB c1ccc2c(c1)[nH]c1c2nnc2nnnn21 34798155 SWKDSDTVYCJYSI-UHFFFAOYSA-N 211.188 0.549 5 40 BCBB Cc1cc([N+](=O)[O-])ccc1NCC(N)=O 36949084 XBFWSHUHLDNSFJ-UHFFFAOYSA-N 209.205 0.800 5 40 BCBB CC(C)n1ncc([N+](=O)[O-])c1CC(=O)O 72209708 PZQACDUXJLUJON-UHFFFAOYSA-N 213.193 0.999 5 40 BCBB CN1CC[C@H](Oc2cccnc2[N+](=O)[O-])C1=O 78757585 KCQIWSGSULMDBR-QMMMGPOBSA-N 237.215 0.599 5 40 BCBB Cc1cc(C(=O)OCC(N)=O)ccc1[N+](=O)[O-] 3274686 PIFPJIQIMQBMAZ-UHFFFAOYSA-N 238.199 0.545 5 40 BCBB Cn1nnnc1NCc1ccc([N+](=O)[O-])cc1 22109703 ZVEQGTUBASYGNP-UHFFFAOYSA-N 234.219 0.730 5 40 BCBB Cn1c(CCN)nc2cc([N+](=O)[O-])ccc21 34925710 RJBVJUGPTJLDHO-UHFFFAOYSA-N 220.232 0.983 5 40 BCBB COC[C@H](C)Nc1ncc([N+](=O)[O-])c(N)n1 56908472 VOYFGHFIASCJFX-YFKPBYRVSA-N 227.224 0.414 5 40 BCBB O=C1CCN[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N1 408736689 FMUVXUOJUITMSX-SNVBAGLBSA-N 237.215 0.409 5 40 BCBB COc1cc([N+](=O)[O-])cc(C(=O)O)c1N 113839598 BXRKLIYRBVZDJC-UHFFFAOYSA-N 212.161 0.884 5 40 BCBB NNCc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 199710889 BJTNRTJTCRMCOH-UHFFFAOYSA-N 212.165 0.466 5 40 BCBB NS(=O)(=O)c1cc([N+](=O)[O-])c(Cl)s1 4253283 CKMLFNQCVNTKHN-UHFFFAOYSA-N 242.665 0.957 5 40 BCBB in-vivo O=[N+]([O-])C[C@H](O)c1cnn(-c2ccccc2)n1 132721 CDAYIXWUSWBNET-JTQLQIEISA-N 234.215 0.577 5 40 BCBB Cc1nn(CC(=O)O)c2ncc([N+](=O)[O-])cc12 12396099 IPVSVIAJDSJJJJ-UHFFFAOYSA-N 236.187 0.733 5 40 BCBB NC(=O)c1cn2ccccc2c1[N+](=O)[O-] 1607732 VYTSEBUIECPIJO-UHFFFAOYSA-N 205.173 0.946 5 40 BCBB N[C@@H]1CCN(c2ncccc2[N+](=O)[O-])C1 50244243 OARZYUTUPOBYGU-SSDOTTSWSA-N 208.221 0.527 5 40 BCBB O=[N+]([O-])c1ccc(C[C@H]2CNCCN2)cc1 68604929 LMAMVUGRWPOOJZ-JTQLQIEISA-N 221.260 0.699 5 40 BCBB O=[N+]([O-])c1cc(-n2cnnc2)ccc1O 85345218 MYQJTOLGJOVWMM-UHFFFAOYSA-N 206.161 0.881 5 40 BCBB NCCn1cc(Br)c([N+](=O)[O-])n1 20313062 BMRBHYUIDPCRLU-UHFFFAOYSA-N 235.041 0.513 5 40 BCBB O=C(NC1CCSCC1)[C@H]1C[C@H]1[N+](=O)[O-] 58421734 CLMRYXYJZAZDJN-JGVFFNPUSA-N 230.289 0.663 5 40 BCBB Cn1nnc(-c2ccc([N+](=O)[O-])cc2)n1 1506060 CEUXZGRTNLGQQW-UHFFFAOYSA-N 205.177 0.785 5 40 BCBB Cc1ccc(CNC(=O)[C@H]2C[C@@H]2[N+](=O)[O-])n1C 32933164 CQJFPTGXTSJWNO-UWVGGRQHSA-N 237.259 0.615 5 40 BCBB Cn1ccnc1[C@](O)(C[N+](=O)[O-])C(F)(F)F 40556074 ASRYJDZWHVCMFE-ZCFIWIBFSA-N 239.153 0.447 5 40 BCBB Nc1c([N+](=O)[O-])cc(CC(=O)O)cc1[N+](=O)[O-] 68675220 NJFIZLNWFNCIEC-UHFFFAOYSA-N 241.159 0.712 5 40 BCBB NC(=O)c1cc(C(=O)O)cc([N+](=O)[O-])c1 12359166 BDXFKMQTIGVLEU-UHFFFAOYSA-N 210.145 0.392 5 40 BCBB in-vitro N[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 4728829 OXOPSXXYBQVJEG-MRVPVSSYSA-N 235.199 0.185 5 40 BCBB Cc1nn2c(=O)c3ccccc3nc2nc1O 1020736 HGCQOVZLNQNRBS-UHFFFAOYSA-N 228.211 0.652 5 40 BCBB Cn1cnn(Cc2ccccc2[N+](=O)[O-])c1=O 95442531 IWKKZVXJJLRZAL-UHFFFAOYSA-N 234.215 0.538 5 40 BCBB Cc1ccc(N)c(S(=O)(=O)O)c1[N+](=O)[O-] 2529768 OTVUVZCOLDTZOY-UHFFFAOYSA-N 232.217 0.732 5 40 BCBB COc1cc2c(c([N+](=O)[O-])c1)NC(=O)C2=O 4783365 KFNPBOSYECQAHA-UHFFFAOYSA-N 222.156 0.738 5 40 BCBB O=[N+]([O-])c1ccc(-n2nnnc2O)cc1 1025969 BVYACBTVBIWVRI-UHFFFAOYSA-N 207.149 0.276 5 40 BCBB CN(CCC(N)=O)Cc1ccccc1[N+](=O)[O-] 27208374 BECABBDKKKXNRR-UHFFFAOYSA-N 237.259 0.902 5 40 BCBB Oc1nc2cc3nc(O)c(O)nc3cc2nc1O 100370958 GPINHNZRWIWEAC-UHFFFAOYSA-N 246.182 0.395 5 40 BCBB CNS(=O)(=O)c1ccc(F)cc1[N+](=O)[O-] 20565111 LMNJQHQXMKSOIM-UHFFFAOYSA-N 234.208 0.642 5 40 BCBB CC(C)c1nn(CCO)c(N)c1[N+](=O)[O-] 87418573 GLXVNLUTZUOGGT-UHFFFAOYSA-N 214.225 0.489 5 40 BCBB O=C1CCN[C@@H](c2ccc([N+](=O)[O-])cc2)N1 209610152 VMORCXRCBGFOGY-SNVBAGLBSA-N 221.216 0.703 5 40 BCBB O=C(O)CNCc1ccc([N+](=O)[O-])cc1 36883052 WNQZQOVOWAVAHI-UHFFFAOYSA-N 210.189 0.769 5 40 BCBB CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)CN 79420840 BJEKIQZIYYTEFS-UHFFFAOYSA-N 237.259 0.902 5 40 BCBB CCCS(=O)(=O)CCn1nccc1[N+](=O)[O-] 89960364 BRMSWNWKNJLKOP-UHFFFAOYSA-N 247.276 0.616 5 40 BCBB N[C@@H]1CC(=O)N(c2ccccc2[N+](=O)[O-])C1=O 4729590 YZQCBASAMUPCDK-ZCFIWIBFSA-N 235.199 0.185 5 40 BCBB NCCn1cc([N+](=O)[O-])c(OCC(F)F)n1 408715896 GKRSCFYRQJFQFK-UHFFFAOYSA-N 236.178 0.394 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)ncn2CCO 173113 MUEGAWWRBFNZCN-UHFFFAOYSA-N 207.189 0.937 5 40 BCBB Cn1nnc(NC(=O)c2ccccc2[N+](=O)[O-])n1 558080 QPDZGBXNIRPXFS-UHFFFAOYSA-N 248.202 0.371 5 40 BCBB Nc1cc([N+](=O)[O-])c(CO)c([N+](=O)[O-])c1 2529763 DTEYAKYAIQIMOY-UHFFFAOYSA-N 213.149 0.578 5 40 BCBB CC(=O)NC1=N[C@@](C)([N+](=O)[O-])CS1 5431323 IWIDYCJWZVHUCE-LURJTMIESA-N 203.223 0.218 5 40 BCBB CS(=O)(=O)CC(=O)c1ccc([N+](=O)[O-])cc1 12336635 VEJBYOJVXBUKPD-UHFFFAOYSA-N 243.240 0.822 5 40 BCBB in-vitro O=[N+]([O-])c1ccc(-n2nncc2CO)cc1 142131264 CRCWXKLIFTWMRI-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB O=[N+]([O-])c1cccc([C@@H](O)S(=O)(=O)O)c1 2810056 KFCUFWYYLITCQC-ZETCQYMHSA-N 233.201 0.474 5 40 BCBB N[C@H](CC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O 6092539 KBJZPNMDKSNLIZ-MRVPVSSYSA-N 238.199 0.580 5 40 BCBB in-vitro O=[N+]([O-])c1cc2c(cc1-c1nnn[nH]1)OCO2 15081628 PJDYSCDPFFYIMP-UHFFFAOYSA-N 235.159 0.504 5 40 BCBB O=[N+]([O-])c1ccc(O)c(-c2nn[nH]n2)c1 8681048 KNWYHWNXNWMIMD-UHFFFAOYSA-N 207.149 0.481 5 40 BCBB NCCCCn1cc([N+](=O)[O-])ccc1=O 33513376 VNPUHDGQRIJCNA-UHFFFAOYSA-N 211.221 0.495 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])n(CC(F)F)n1 72209690 MUHNJSAMXPZRNQ-UHFFFAOYSA-N 221.119 0.755 5 40 BCBB O=[N+]([O-])c1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c1 33503576 WETFHJRYOTYZFD-DJLDLDEBSA-N 228.204 0.037 5 40 BCBB O=C(Cn1cccc([N+](=O)[O-])c1=O)c1ccc[nH]1 58404784 PVLUROHEZOMKFR-UHFFFAOYSA-N 247.210 0.968 5 40 BCBB Cn1nnc(NC(=O)c2cccc([N+](=O)[O-])c2)n1 529633 IUHTUNFJXAFTRT-UHFFFAOYSA-N 248.202 0.371 5 40 BCBB CC[C@H](C)NC(=O)Cn1cnc([N+](=O)[O-])c1 823959 DAZXOKDGJLLSOZ-ZETCQYMHSA-N 226.236 0.706 5 40 BCBB N[C@H](C(=O)O)[C@@H](O)c1cccc([N+](=O)[O-])c1 226257 MBHARJQAJLMPIU-YUMQZZPRSA-N 226.188 0.040 5 40 BCBB biogenic,in-vitro O=[N+]([O-])c1cccc(N(CCO)CCO)c1 4822408 CMFNTWPAEFXJIU-UHFFFAOYSA-N 226.232 0.386 5 40 BCBB CNC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1 60850 JSIAPOBUIUFYCL-UHFFFAOYSA-N 238.199 0.741 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)N[C@@H](O)[C@H](O)N2 5955887 UECLGMYJNJOYES-YUMQZZPRSA-N 211.177 0.069 5 40 BCBB CNC(=O)CN(C)c1ccc([N+](=O)[O-])cn1 18057163 ILEOOZJPLJXMCJ-UHFFFAOYSA-N 224.220 0.172 5 40 BCBB NNc1ccc([N+](=O)[O-])c(N2CCOCC2)c1 4549017 RFEGRESJUFDNQR-UHFFFAOYSA-N 238.247 0.717 5 40 BCBB CCC1(O)CN(C(=O)c2cc([N+](=O)[O-])c[nH]2)C1 89649390 QCXKOPWNEVSGDV-UHFFFAOYSA-N 239.231 0.520 5 40 BCBB COCCNCc1cc([N+](=O)[O-])nn1C 408717371 YZPFORNFWQXGDQ-UHFFFAOYSA-N 214.225 0.064 5 40 BCBB CCOC(=O)[C@H](CC)[C@](C)(O)C[N+](=O)[O-] 5467615 POFPSRKAOLOFKX-IONNQARKSA-N 219.237 0.603 5 40 BCBB C[C@H](C(=O)O)n1ccc(=O)c([N+](=O)[O-])c1 133127805 SRSLFOHXMOCWKD-RXMQYKEDSA-N 212.161 0.402 5 40 BCBB NCCCC(CCCN)(CCCN)[N+](=O)[O-] 14909855 FCIGUPDFRXUJSZ-UHFFFAOYSA-N 232.328 0.219 5 40 BCBB Cc1ncc([N+](=O)[O-])n1Cc1nnnn1C1CC1 96480741 AYGGERGUWSZPLZ-UHFFFAOYSA-N 249.234 0.469 5 40 BCBB CCOC(=O)C[C@@H](C(=O)OCC)[C@@H](C)[N+](=O)[O-] 32911432 GVCIHMUGJCWCKR-HTQZYQBOSA-N 247.247 0.784 5 40 BCBB Cl/C=C/C[N+]12CN3CN(CN(C3)C1)C2 19319483 LDLCEGCJYSDJLX-OWOJBTEDSA-N 215.708 0.248 5 40 BCBB in-vitro N[C@H](CC(=O)O)c1cc(O)ccc1[N+](=O)[O-] 44196803 WSMXFDBLFDKLBJ-SSDOTTSWSA-N 226.188 0.775 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@H]1CO 42434630 WSINBJLAIAPDTI-ZETCQYMHSA-N 226.236 0.289 5 40 BCBB Cc1cc(C)n(C(=O)c2nc[nH]c2[N+](=O)[O-])n1 4715195 HVUROEOAOOYNBT-UHFFFAOYSA-N 235.203 0.820 5 40 BCBB COC(=O)CCC(CCC(=O)OC)[N+](=O)[O-] 1727252 JWWGSSBSDDOWPP-UHFFFAOYSA-N 233.220 0.538 5 40 BCBB O=[N+]([O-])c1ccc([C@H]2CNCCN2)cc1 4203756 WWRUGVIJFUXWFW-SNVBAGLBSA-N 207.233 0.829 5 40 BCBB O=C(O)CNc1cc([N+](=O)[O-])ccc1C(=O)O 44197542 ZNPDQLNSPHZPLC-UHFFFAOYSA-N 240.171 0.790 5 40 BCBB CN(CCCN)Cc1ccc(N)c([N+](=O)[O-])c1 97095588 HEDHVYBTMIVOEJ-UHFFFAOYSA-N 238.291 0.958 5 40 BCBB O=C(c1ccc([N+](=O)[O-])cc1)N1CCCN1 35855273 VVXFHCNNSTZXHT-UHFFFAOYSA-N 221.216 0.945 5 40 BCBB COCCCNCc1cc([N+](=O)[O-])nn1C 408717305 YDPIVORWMCWWQH-UHFFFAOYSA-N 228.252 0.454 5 40 BCBB O=C(O)C(=O)Nc1cccc([N+](=O)[O-])c1 1669680 CROYMQQHSFRWHS-UHFFFAOYSA-N 210.145 0.618 5 40 BCBB O=C(O[C@H]1CCOC1=O)c1ccc([N+](=O)[O-])o1 3329288 YFXHFWKTKINLHY-LURJTMIESA-N 241.155 0.660 5 40 BCBB Nc1ccc(-n2cnnc2)cc1[N+](=O)[O-] 216752128 INBWNVSJXGHXNZ-UHFFFAOYSA-N 205.177 0.758 5 40 BCBB C[C@H]1[C@@H](C)N1C[C@H](O)Cn1ccnc1[N+](=O)[O-] 1607605 VKUQQJFQNDTATQ-HFJXHZNHSA-N 240.263 0.245 5 40 BCBB in-vitro C[N+](C)(C)CCCSC1=NCCN1 1675931 ILMNGSKVQMXEKB-UHFFFAOYSA-N 202.347 0.775 5 40 BCBB Cc1ncc([N+](=O)[O-])n1Cc1cnn(C)c1 69951742 ARGWQGHMENUHFL-UHFFFAOYSA-N 221.220 0.882 5 40 BCBB O=[N+]([O-])c1ccc2nn([N+](=O)[O-])cc2c1 1589046 OLQMYJIVJQYMNX-UHFFFAOYSA-N 208.133 0.984 5 40 BCBB N[C@H](C(=O)O)c1cc([N+](=O)[O-])ccc1F 72196208 DELDOAFYXJXETF-ZETCQYMHSA-N 214.152 0.818 5 40 BCBB NC(=O)CC(=O)c1cccc([N+](=O)[O-])c1 1705723 QUIDXCJDNOMICO-UHFFFAOYSA-N 208.173 0.653 5 40 BCBB Cc1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])no1 6413415 JPSNGXZCSOGMLG-UHFFFAOYSA-N 237.175 0.867 5 40 BCBB CN(CCN)Cc1ccc([N+](=O)[O-])cc1 54416840 HWRLSVUQBCNZRM-UHFFFAOYSA-N 209.249 0.985 5 40 BCBB O=[N+]([O-])c1ccc(N2C=NC=NC[C@H]2O)cc1 71405322 XSXJOLPYSKSTKQ-SNVBAGLBSA-N 234.215 0.790 5 40 BCBB CO[C@@H]1[C@H](OC)[C@@H]2CC(=O)C[C@H]1[N+]2(C)C 5031466 HWLHUCCBZFCIKY-CKIJPRSSSA-N 214.285 0.207 5 40 BCBB O=[N+]([O-])c1cnc(NCCO)c([N+](=O)[O-])c1 19537588 ZJKASMZYORAQRI-UHFFFAOYSA-N 228.164 0.302 5 40 BCBB NC(=O)N[C@@H](C(=O)O)c1ccccc1[N+](=O)[O-] 71602881 LTRMBSQYWCCNEI-SSDOTTSWSA-N 239.187 0.389 5 40 BCBB O=C1N[C@@H](O)c2cccc([N+](=O)[O-])c2O1 5461625 QWLTXKMLYXNKQL-ZETCQYMHSA-N 210.145 0.688 5 40 BCBB CCOC(=O)c1cc(C)[nH]c(=O)c1[N+](=O)[O-] 8628001 DICRVETZCMISTM-UHFFFAOYSA-N 226.188 0.768 5 40 BCBB CCOc1nn([C@H](C)C(=O)OC)cc1[N+](=O)[O-] 253398896 HURNCJIEMJBEBI-ZCFIWIBFSA-N 243.219 0.924 5 40 BCBB CNc1ccc(C(=O)OCCO)cc1[N+](=O)[O-] 21734526 ZGUMIWIDDRBJOG-UHFFFAOYSA-N 240.215 0.786 5 40 BCBB O=[N+]([O-])c1ccsc1NC[C@@H](O)CO 95986675 FOFKPRNMEBHENM-RXMQYKEDSA-N 218.234 0.421 5 40 BCBB COC(=O)CNc1ncccc1[N+](=O)[O-] 20550397 HQRFIOILJHNISR-UHFFFAOYSA-N 211.177 0.575 5 40 BCBB in-vitro c1nc([N+]23CN4CN(CN(C4)C2)C3)cs1 1857794602 DFZSJQUKNNATKU-UHFFFAOYSA-N 224.313 0.142 5 40 BCBB Nc1nc(Sc2ncccc2[N+](=O)[O-])n[nH]1 13658485 CCPZMXJLTACKKZ-UHFFFAOYSA-N 238.232 0.841 5 40 BCBB CNC(=O)c1ccc([N+](=O)[O-])c(OC)c1 71405329 AOQDJNLPLPYKIN-UHFFFAOYSA-N 210.189 0.963 5 40 BCBB in-vitro Cc1nnc2c([N+](=O)[O-])c(N)c(Cl)nn12 5552735 CXFKSGGFPHMUSK-UHFFFAOYSA-N 228.599 0.577 5 40 BCBB COc1ccc(-n2nnnc2C)cc1[N+](=O)[O-] 8375419 MFPDSTUCRAKGEK-UHFFFAOYSA-N 235.203 0.888 5 40 BCBB Cc1nn(C)c(C(=O)NC(C)C)c1[N+](=O)[O-] 95116760 OOHBGPORYKOWJK-UHFFFAOYSA-N 226.236 0.775 5 40 BCBB COCCCNc1nn(C)cc1[N+](=O)[O-] 95098527 BYKCSOJLAWVEDE-UHFFFAOYSA-N 214.225 0.777 5 40 BCBB O=[N+]([O-])c1ccc(OS(=O)(=O)O)c(O)c1 4261905 ZVUSRLPQGXIZPO-UHFFFAOYSA-N 235.173 0.482 5 40 BCBB COC(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-] 47874053 XTIRYUVBVZEHLG-ZCFIWIBFSA-N 226.188 0.930 5 40 BCBB O=[N+]([O-])C[C@H](O)c1cccc([N+](=O)[O-])c1 59186186 IBFRLMGYDNNEOC-QMMMGPOBSA-N 212.161 0.905 5 40 BCBB CCOc1n[nH]c(C(=O)O)c1[N+](=O)[O-] 39084933 BIRMXKBYQVCDSU-UHFFFAOYSA-N 201.138 0.415 5 40 BCBB COC(=O)c1cn([C@H](C)C(=O)O)nc1[N+](=O)[O-] 408716949 TVGWMAWOSNBGGD-SCSAIBSYSA-N 243.175 0.224 5 40 BCBB O=[N+]([O-])c1cccc([C@H](O)S(=O)(=O)O)c1 2810057 KFCUFWYYLITCQC-SSDOTTSWSA-N 233.201 0.474 5 40 BCBB NC(=O)c1nc2ccccn2c1[N+](=O)[O-] 13207412 YBFBWGPGEAAJQR-UHFFFAOYSA-N 206.161 0.341 5 40 BCBB N[C@@H](CC(=O)O)c1ccc(O)c([N+](=O)[O-])c1 44196798 DVXMODFUHCVXIE-LURJTMIESA-N 226.188 0.775 5 40 BCBB CCOn1nnc2c([N+](=O)[O-])cccc21 1610885 QQJOEGSQUHZOFV-UHFFFAOYSA-N 208.177 0.788 5 40 BCBB CCC1([N+](=O)[O-])COP(=O)(N2CC2)OC1 1700840 NYUKAUJMJZJATL-UHFFFAOYSA-N 236.164 0.882 5 40 BCBB O=[N+]([O-])c1ncn(Cc2nc(Cl)n[nH]2)n1 95116219 ILJVDEXQBYIJSJ-UHFFFAOYSA-N 229.587 0.006 5 40 BCBB O=C1C=C[C@@H](O)N1c1ccc([N+](=O)[O-])cc1 199414857 UKJLFJHXHQTPQG-SECBINFHSA-N 220.184 0.816 5 40 BCBB O=[N+]([O-])c1cccnc1N1CCC[C@H]1CO 42434651 YBIZHYVHQBRYBD-QMMMGPOBSA-N 223.232 0.951 5 40 BCBB CCn1nc(-c2nnc(N)s2)cc1[N+](=O)[O-] 408717861 YDOBRIIRKVNGLU-UHFFFAOYSA-N 240.248 0.912 5 40 BCBB O=[N+]([O-])c1ncn(-c2cc(Cl)ncn2)n1 1307211982 RIHSZRXKLOKQNX-UHFFFAOYSA-N 226.583 0.619 5 40 BCBB Cn1nnc(-c2ccc(F)c([N+](=O)[O-])c2)n1 217473412 LQYZWRSHNLIATL-UHFFFAOYSA-N 223.167 0.924 5 40 BCBB COC(=O)c1ccc([N+](=O)[O-])cc1-n1cnnn1 8816173 FGXGKZAIUXYCHV-UHFFFAOYSA-N 249.186 0.357 5 40 BCBB COC(=O)[C@@H](N)c1cccc([N+](=O)[O-])c1 14984266 BLBIOXMHBZZVRA-QMMMGPOBSA-N 210.189 0.768 5 40 BCBB C[N+](C)(C)C[C@@H]1CC[C@@H](C[N+](C)(C)C)C1=O 1617303 VYANHMVPRSBSJH-RYUDHWBXSA-N 228.380 0.994 5 40 BCBB CC(C)Oc1nn(CCCN)cc1[N+](=O)[O-] 408716532 NXQLGIKJMRGBDM-UHFFFAOYSA-N 228.252 0.927 5 40 BCBB CC(=O)Cn1cnc([N+](=O)[O-])c1[N+](=O)[O-] 4343644 DZTOCWZGMIQRRX-UHFFFAOYSA-N 214.137 0.289 5 40 BCBB Cc1nn(C)c(N2CCC(O)CC2)c1[N+](=O)[O-] 40437194 BLUPSNYHNJPLIX-UHFFFAOYSA-N 240.263 0.598 5 40 BCBB O=C(O)c1ccc(P(=O)(O)O)c([N+](=O)[O-])c1 1870297 ODZIVPXSEQHKBS-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB CCOc1nn([C@@H](C)C(=O)O)cc1[N+](=O)[O-] 253399472 JKUJWIZRUWNYKG-YFKPBYRVSA-N 229.192 0.836 5 40 BCBB CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O 3161144 QSPIBYNJSHIKHH-UHFFFAOYSA-N 241.159 0.568 5 40 BCBB NCCn1cc([N+](=O)[O-])c(C(F)(F)F)n1 20313051 BKBMBCQQMRUXHR-UHFFFAOYSA-N 224.142 0.769 5 40 BCBB O=C(O)c1c([N+](=O)[O-])cccc1P(=O)(O)O 1870300 XQRYIAGXGLNCHK-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB Cc1cnc(NC(C)(CO)CO)c([N+](=O)[O-])c1 95412150 IHRFAWLTMCSOMQ-UHFFFAOYSA-N 241.247 0.453 5 40 BCBB O=C(O)c1cc(P(=O)(O)O)ccc1[N+](=O)[O-] 1870293 VYNWQFVKKHWKCV-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB COCCNC(=O)c1ccc([N+](=O)[O-])o1 4671917 AOOAXYLQUXBWQX-UHFFFAOYSA-N 214.177 0.564 5 40 BCBB C[C@@H](CO)N(C)c1ccc([N+](=O)[O-])nc1 95449494 ZOCVFMOIKBRSAQ-ZETCQYMHSA-N 211.221 0.807 5 40 BCBB O=[N+]([O-])c1ccc(OC[C@H]2CNCCO2)cc1 80760359 UFWMAKQTLPXLGR-LLVKDONJSA-N 238.243 0.962 5 40 BCBB CCOC(=O)c1cc([N+](=O)[O-])nn1CC 238854116 MUTNJDXTSJPCNH-UHFFFAOYSA-N 213.193 0.988 5 40 BCBB O=C(Nc1ccc([N+](=O)[O-])cc1)C(=O)NC1CC1 5250791 PSRXEEQODHOZRL-UHFFFAOYSA-N 249.226 0.812 5 40 BCBB C[C@@H]1CN(c2ccc([N+](=O)[O-])cn2)CCN1 15443315 XYMPRRMVLJQEAW-MRVPVSSYSA-N 222.248 0.788 5 40 BCBB C[N+](CCO)(CCO)Cc1ccccc1 1451703 TYORFRRVUWSPEW-UHFFFAOYSA-N 210.297 0.618 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H]1CO 42434629 WSINBJLAIAPDTI-SSDOTTSWSA-N 226.236 0.289 5 40 BCBB O=[N+]([O-])c1ccncc1N1CCOCC1 95081280 POBLYWGGUODRRV-UHFFFAOYSA-N 209.205 0.826 5 40 BCBB O=C(c1n[nH]cc1[N+](=O)[O-])N1CCCCO1 189580499 XEBTUCIPHZIWLL-UHFFFAOYSA-N 226.192 0.486 5 40 BCBB COc1c[n+]([O-])c(OC)cc1[N+](=O)[O-] 5512036 BECAMZJBHJRKRZ-UHFFFAOYSA-N 200.150 0.245 5 40 BCBB O=C(O)c1ccn(-c2ccc([N+](=O)[O-])cn2)n1 12395486 OKNVKICWIBYTJA-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB COC(=O)[C@H](N)c1cccc([N+](=O)[O-])c1 14984971 BLBIOXMHBZZVRA-MRVPVSSYSA-N 210.189 0.768 5 40 BCBB CC(=O)CC(=O)Nc1ncc([N+](=O)[O-])s1 6022409 DYKPIIMOEJFSQZ-UHFFFAOYSA-N 229.217 0.969 5 40 BCBB COC(=O)[C@H](O)c1ccccc1[N+](=O)[O-] 3846259 FIPPVJRVIBXUJD-MRVPVSSYSA-N 211.173 0.801 5 40 BCBB biogenic O=[N+]([O-])c1ccc(O[C@H]2CCNC2)nc1 42783017 GQHRIECAOQIFLJ-QMMMGPOBSA-N 209.205 0.731 5 40 BCBB O=[N+]([O-])c1cccc(OC[C@H]2CNCCO2)c1 80760364 RNYZSTAAKUCYPH-LLVKDONJSA-N 238.243 0.962 5 40 BCBB O=[N+]([O-])[C@H]1CCN(Cc2ccccc2)[C@@H]1O 13535487 GJSZKSQTYVGJMO-WDEREUQCSA-N 222.244 0.856 5 40 BCBB CNCC(=O)Nc1ccc([N+](=O)[O-])cc1 4181881 IROUMQDAFLZIDG-UHFFFAOYSA-N 209.205 0.753 5 40 BCBB C[N+](C)(C)[C@@]12CCC[C@@H]1S(=O)(=O)C2 1725392 YDUTUONQGSGYEP-DTWKUNHWSA-N 204.315 0.412 5 40 BCBB Cn1nc(-c2nnc(N)s2)cc1[N+](=O)[O-] 408717606 JZKZTCXFBWVBKJ-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB N[C@H](C(=O)O)[C@H](O)c1cccc([N+](=O)[O-])c1 226258 MBHARJQAJLMPIU-JGVFFNPUSA-N 226.188 0.040 5 40 BCBB biogenic,in-vitro Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1N 95098696 VHAROBFFVFEZRV-UHFFFAOYSA-N 210.115 0.832 5 40 BCBB O=C1NC(=O)[C@@]2(Cc3ccc([N+](=O)[O-])cc3C2)N1 2547790 MTLBOQSPYBYFJF-NSHDSACASA-N 247.210 0.272 5 40 BCBB O=C(O)[C@@H]1CNC[C@H]1c1cccc([N+](=O)[O-])c1 4241634 FQRPQUABFIUZMG-VHSXEESVSA-N 236.227 0.982 5 40 BCBB N[C@@H](C(=O)O)[C@@H](O)c1cccc([N+](=O)[O-])c1 226259 MBHARJQAJLMPIU-SFYZADRCSA-N 226.188 0.040 5 40 BCBB biogenic,in-vitro CO[C@@H]([C@@H](OC)[N+](C)(C)C)[N+](C)(C)C 13398623 PNXZJSVFTBMPKF-AOOOYVTPSA-N 206.330 0.344 5 40 BCBB O=C1CCN[C@H](c2cccc([N+](=O)[O-])c2)N1 206544329 VKUFEMWAMQZKDT-JTQLQIEISA-N 221.216 0.703 5 40 BCBB Cn1cc([N+](=O)[O-])c(/C=C/N2CCOCC2)n1 49949243 IOZRAWHCEMNADN-NSCUHMNNSA-N 238.247 0.631 5 40 BCBB O=c1[nH]c2cc(Cl)c([N+](=O)[O-])nc2[nH]1 8691596 MDGIJRXZFHSEIZ-UHFFFAOYSA-N 214.568 0.813 5 40 BCBB CC(C)(C)OC(=O)N[C@@H](CC[N+](=O)[O-])C(=O)O 408526113 DTLVFZDRGQZIKM-LURJTMIESA-N 248.235 0.631 5 40 BCBB CC(C)(C)OC(=O)N1CC[C@](CO)([N+](=O)[O-])C1 1565504747 BCKWHZDDYNPWJF-JTQLQIEISA-N 246.263 0.635 5 40 BCBB C[N+](C)(C)[C@]12CCC[C@@H]1S(=O)(=O)C2 5052411 YDUTUONQGSGYEP-IUCAKERBSA-N 204.315 0.412 5 40 BCBB C[C@]1(O)CC[C@@H](O)C[C@@H]1CC[N+](C)(C)[O-] 5495688 OYIIBRVYRBWAJY-AXFHLTTASA-N 217.309 0.863 5 40 BCBB O=C(NC1CCSCC1)[C@H]1C[C@@H]1[N+](=O)[O-] 58421732 CLMRYXYJZAZDJN-YUMQZZPRSA-N 230.289 0.663 5 40 BCBB C[N+]1([C@H]2C[C@H]3CC[C@@H]2C3=O)CCOCC1 5029992 ZYOJMOBGJMTZFJ-VWYCJHECSA-N 210.297 0.831 5 40 BCBB CN(C)S(=O)(=O)Oc1ccccc1[N+](=O)[O-] 1756489 DUFOSISFAFIZAF-UHFFFAOYSA-N 246.244 0.780 5 40 BCBB N=C(N)c1cc(C(=N)N)cc([N+](=O)[O-])c1 3161158 FOVVSKFFJUIPAR-UHFFFAOYSA-N 207.193 0.163 5 40 BCBB O=C(N=c1[nH]c2ccccc2[nH]1)[C@H]1C[C@@H]1[N+](=O)[O-] 52555089 MDAXYSKDHYPNTG-RCOVLWMOSA-N 246.226 0.589 5 40 BCBB NCCc1nc(-c2cccc([N+](=O)[O-])c2)n[nH]1 61844089 IOFARJZAWHBNIB-UHFFFAOYSA-N 233.231 0.881 5 40 BCBB Cn1nc(Br)nc1[N+](=O)[O-] 95116215 HHZWEUCNEAMILU-UHFFFAOYSA-N 206.987 0.486 5 40 BCBB NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 42267758 QTSRHPKNZCCTQF-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB COC[C@@H](O)CNc1ncc([N+](=O)[O-])cc1C 71271786 LWDNXZXRCQUXQH-VIFPVBQESA-N 241.247 0.717 5 40 BCBB CN[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O 77336632 AQKMYHBKZMBFDY-SECBINFHSA-N 224.216 0.810 5 40 BCBB CNS(=O)(=O)c1cccc([N+](=O)[O-])c1C 21039710 HEKCHHKYUHYVMF-UHFFFAOYSA-N 230.245 0.811 5 40 BCBB O=C(O)c1cn(CC(F)F)nc1[N+](=O)[O-] 95836858 DVKPUCKMLLKMJE-UHFFFAOYSA-N 221.119 0.755 5 40 BCBB Cc1cc(S(=O)(=O)O)c([N+](=O)[O-])cc1N 2529767 VFGHXLXVWVJPBI-UHFFFAOYSA-N 232.217 0.732 5 40 BCBB O=c1cc2ncc(-n3cc([N+](=O)[O-])cn3)cn2[nH]1 54925 TYLYXKJAVLSNFG-UHFFFAOYSA-N 246.186 0.117 5 40 BCBB Cn1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2)n1 558083 ORHMTWNXQZKYBH-UHFFFAOYSA-N 248.202 0.371 5 40 BCBB COc1ccc([N+](=O)[O-])c2no[n+]([O-])c12 4860008 IXWCXFUQYRQQJS-UHFFFAOYSA-N 211.133 0.378 5 40 BCBB Cn1nc2cc(C(=O)O)cc([N+](=O)[O-])c2n1 218257997 HWKXXFCUFRLYJZ-UHFFFAOYSA-N 222.160 0.575 5 40 BCBB COc1n[n+]([O-])c(Cl)cc1[N+](=O)[O-] 1566755 GFPCWCFJENKFAV-UHFFFAOYSA-N 205.557 0.285 5 40 BCBB CCOC(=O)CSc1c([N+](=O)[O-])ncn1C 1670439 YNDYDPYXEQAIMP-UHFFFAOYSA-N 245.260 0.984 5 40 BCBB CC[C@H](Nc1c([N+](=O)[O-])c(C)nn1C)C(=O)O 36748987 GNWQCEXIZYRDKD-LURJTMIESA-N 242.235 0.912 5 40 BCBB N[C@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 100672677 UZSPTZBSWXIJBI-QMMMGPOBSA-N 235.199 0.185 5 40 BCBB COC(=O)c1nn(C(F)F)cc1[N+](=O)[O-] 408717012 UUJRQCMAGPQIMI-UHFFFAOYSA-N 221.119 0.973 5 40 BCBB COc1nc(Cl)nc(N)c1[N+](=O)[O-] 4087417 PFQFMTDRIFQRSS-UHFFFAOYSA-N 204.573 0.629 5 40 BCBB in-vitro C[N+](C)(C)CN1C(=O)c2ccccc2C1=O 164221 LVGOPSLNEONSJG-UHFFFAOYSA-N 219.264 0.946 5 40 BCBB CCNS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1 36904751 UQMRLBVAKNCFJM-UHFFFAOYSA-N 246.244 0.599 5 40 BCBB C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O 1467778 CDBXKLYOJGRINM-ZCFIWIBFSA-N 238.199 0.798 5 40 BCBB CN(CC(N)=O)C(=O)c1cccc([N+](=O)[O-])c1 46980223 DICBEXHGAZRKQM-UHFFFAOYSA-N 237.215 0.152 5 40 BCBB Cc1nc(N2CC2)nc(N2CC2)c1[N+](=O)[O-] 4215762 QMFATHWBIVVHPH-UHFFFAOYSA-N 221.220 0.333 5 40 BCBB C[C@H](C(=O)N1CCCC1)n1cc([N+](=O)[O-])cn1 4686649 BVFSTJQZSRJYPT-MRVPVSSYSA-N 238.247 0.975 5 40 BCBB O=C(O)c1ccc(P(=O)(O)O)cc1[N+](=O)[O-] 1870298 GIUVQJYQXOHQFI-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB O=[N+]([O-])c1cc2n[nH]nc2cc1[N+](=O)[O-] 4530104 JPRYBINHZZTLIF-UHFFFAOYSA-N 209.121 0.774 5 40 BCBB CC(C)CC[N+]12CN3CN(CN(C3)C1)C2 96517694 SLKDEUBMZXYVDR-UHFFFAOYSA-N 211.333 0.541 5 40 BCBB O=[N+]([O-])c1cc2nonc2c2n[nH]nc12 18181377 WQEUWGIDYRXUOH-UHFFFAOYSA-N 206.121 0.402 5 40 BCBB COC(=O)c1cc(CO)cc([N+](=O)[O-])c1 39186279 NNMLFVLQJJIINL-UHFFFAOYSA-N 211.173 0.874 5 40 BCBB in-vitro CC(C)N1CC[C@@H](n2cc([N+](=O)[O-])cn2)C1=O 97047996 IVWYRQXWXYMIJR-SECBINFHSA-N 238.247 0.973 5 40 BCBB O=C(CCn1cc([N+](=O)[O-])cn1)N1CCCC1 2770989 VXNYLAIPPXQCDN-UHFFFAOYSA-N 238.247 0.804 5 40 BCBB Nc1ncc([N+](=O)[O-])cc1C(=O)N1CCCC1 196182563 FEXPBDBGIDRDQA-UHFFFAOYSA-N 236.231 0.808 5 40 BCBB [O-][N+](CCO)(CCO)Cc1ccccc1 394547 UTHKQMVYZRWSKD-UHFFFAOYSA-N 211.261 0.486 5 40 BCBB in-vitro COc1cc(S(N)(=O)=O)ccc1[N+](=O)[O-] 75772126 ITLDNUYYVVFHER-UHFFFAOYSA-N 232.217 0.251 5 40 BCBB COCCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 17321369 BXAZGJRSUHDFTA-UHFFFAOYSA-N 239.231 0.553 5 40 BCBB CN(C)CCCNc1ncc([N+](=O)[O-])c(N)n1 71286111 YIWZLWNQMFWNNV-UHFFFAOYSA-N 240.267 0.331 5 40 BCBB Cc1ncc([N+](=O)[O-])n1CCOCCO 31559575 UGPDZGBXWBKFMT-UHFFFAOYSA-N 215.209 0.109 5 40 BCBB in-vitro C[C@H](N)C(=O)OCc1ccc([N+](=O)[O-])cc1 34781694 YCNGTSKOSZDDTR-ZETCQYMHSA-N 224.216 0.985 5 40 BCBB in-vitro O=C1C[C@H](n2cc([N+](=O)[O-])cn2)[C@@H]2CO[C@@H]1O2 100021500 RHTZTGMVZGRMHG-CNUIFLNQSA-N 239.187 0.047 5 40 BCBB N[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 50244252 YDHYUFZBCLPOHD-SSDOTTSWSA-N 208.221 0.527 5 40 BCBB COc1cc(C)nc(-n2cc([N+](=O)[O-])cn2)n1 96447877 JOBIPXFTCVQAOF-UHFFFAOYSA-N 235.203 0.888 5 40 BCBB O=[N+]([O-])c1ccn(CCN2CCOCC2)n1 114015782 WUUOYCBAZSXMST-UHFFFAOYSA-N 226.236 0.124 5 40 BCBB CNS(=O)(=O)c1ccc(O)cc1[N+](=O)[O-] 2562564 SVSURUJTMSPMFM-UHFFFAOYSA-N 232.217 0.209 5 40 BCBB O=[N+]([O-])c1c(Cl)ncnc1N1CCOCC1 4243347 MIPDXPRZNICKKZ-UHFFFAOYSA-N 244.638 0.875 5 40 BCBB C[C@H]1Oc2ccc([N+](=O)[O-])nc2NC1=O 76750275 AMZNFBGOBSQKFR-SCSAIBSYSA-N 209.161 0.709 5 40 BCBB COC(=O)c1nn2c(c1[N+](=O)[O-])C(=O)CCC2 115014028 BZHLKAUXINNCBQ-UHFFFAOYSA-N 239.187 0.554 5 40 BCBB C[C@H]1CN(c2ccc([N+](=O)[O-])cn2)CCN1 15443317 XYMPRRMVLJQEAW-QMMMGPOBSA-N 222.248 0.788 5 40 BCBB COC(=O)[C@@H](N)c1ccc([N+](=O)[O-])cc1 21983972 JQQJZFRFDFGUPU-QMMMGPOBSA-N 210.189 0.768 5 40 BCBB O=C(OCc1ccno1)[C@H]1C[C@H]1[N+](=O)[O-] 89885095 JOJLCHDWKQIRJJ-NKWVEPMBSA-N 212.161 0.383 5 40 BCBB CC(C)Oc1nn(CC(=O)O)cc1[N+](=O)[O-] 408716976 UGXAIRABBQZORT-UHFFFAOYSA-N 229.192 0.663 5 40 BCBB NS(=O)(=O)c1cc(F)cc([N+](=O)[O-])c1 36379744 NGLZODITESTMCJ-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB in-vitro C[N+](C)(C)Cc1nnnn1-c1ccccc1 4828162 FYEVPYKECRVSPJ-UHFFFAOYSA-N 218.284 0.869 5 40 BCBB COC(=O)c1cc2[nH]c(=O)[nH]c2cc1[N+](=O)[O-] 80943411 HFGWDAJRQPDESB-UHFFFAOYSA-N 237.171 0.551 5 40 BCBB Nc1ccc([N+](=O)[O-])cc1-n1cnnc1 216752181 SNBXULDGIYOPJR-UHFFFAOYSA-N 205.177 0.758 5 40 BCBB O=c1[nH]c(O)nc(C(F)(F)F)c1[N+](=O)[O-] 1593638 BOZXEOUYOAGQOK-UHFFFAOYSA-N 225.082 0.403 5 40 BCBB COc1cc(C(=N)N)c([N+](=O)[O-])cc1OC 199559426 NSHUFAHSIPDPPW-UHFFFAOYSA-N 225.204 0.896 5 40 BCBB CNC(=O)c1c([N+](=O)[O-])c(C(C)(C)C)nn1C 506156 DJIFAQNHSGKGHS-UHFFFAOYSA-N 240.263 0.985 5 40 BCBB O=[N+]([O-])c1ccc(CNc2nn[nH]n2)cc1 22109472 NSDSUBZSRGNJQT-UHFFFAOYSA-N 220.192 0.720 5 40 BCBB NC(=O)C[C@H](O)c1ccccc1[N+](=O)[O-] 4843962 OXRRMNGBCBMHEX-QMMMGPOBSA-N 210.189 0.504 5 40 BCBB O=[N+]([O-])c1cccnc1N1CCC[C@@H](O)C1 23709404 FSZUZUBPJAFQOU-MRVPVSSYSA-N 223.232 0.951 5 40 BCBB CCC1([N+](=O)[O-])COP(N)(=O)OC1 1702943 OZCIRPFCEFELQM-UHFFFAOYSA-N 210.126 0.526 5 40 BCBB Nc1ncc([N+](=O)[O-])c(N2CCCC2)n1 5445314 YIUCWNHARYVMKW-UHFFFAOYSA-N 209.209 0.567 5 40 BCBB NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1N 20282295 GEPJQVIYRWIWBA-UHFFFAOYSA-N 247.214 0.462 5 40 BCBB O=[N+]([O-])c1cc(-n2cnnn2)ccc1F 4508843 NIIMNMPJTRAFKO-UHFFFAOYSA-N 209.140 0.710 5 40 BCBB N[C@@H](CC(=O)O)c1ccc([N+](=O)[O-])c(O)c1 44216319 HWEMRMVSMAWIRB-LURJTMIESA-N 226.188 0.775 5 40 BCBB CCOC(=O)CCn1cc([N+](=O)[O-])cn1 2505981 RTUQSGIUSVTNEX-UHFFFAOYSA-N 213.193 0.745 5 40 BCBB Cn1c2ccccc2c2nn3nnnc3nc21 5799149 RTPPLDQYMYMCCF-UHFFFAOYSA-N 225.215 0.559 5 40 BCBB O=[N+]([O-])c1cccc(CNCCNCCO)c1 16399852 AESPNJVFJKYOAG-UHFFFAOYSA-N 239.275 0.266 5 40 BCBB Cc1ccc2nc3nc(O)[nH]c(=O)c3nc2c1 236595 CGIVSENFCUVWGX-UHFFFAOYSA-N 228.211 0.880 5 40 BCBB CCS(=O)(=O)CCn1cc([N+](=O)[O-])nc1C 548334 GHJQUSZGINOURI-UHFFFAOYSA-N 247.276 0.534 5 40 BCBB O=c1ccn(Cc2ccc([N+](=O)[O-])cc2)c(=O)[nH]1 1703033 BMTCZXDZXFKKMD-UHFFFAOYSA-N 247.210 0.493 5 40 BCBB Cc1[nH]c(=O)c([N+](=O)[O-])c(C)c1[N+](=O)[O-] 3094550 CSDVXLFTIOUXSB-UHFFFAOYSA-N 213.149 0.808 5 40 BCBB Cc1nc(SC[C@H](O)CO)c([N+](=O)[O-])[nH]1 5690849 AWINWOPSZIVRLW-RXMQYKEDSA-N 233.249 0.072 5 40 BCBB O=C(NCc1nccs1)[C@@H]1C[C@@H]1[N+](=O)[O-] 65474646 KJAOTAPNEOTDFY-RITPCOANSA-N 227.245 0.425 5 40 BCBB Cc1nnnn1-c1ccc([N+](=O)[O-])cc1 4530632 GKPOODCBYGIDMF-UHFFFAOYSA-N 205.177 0.879 5 40 BCBB CC(=O)OCCn1c([N+](=O)[O-])cnc1C 5425141 MQXDTGGRMOLAPU-UHFFFAOYSA-N 213.193 0.663 5 40 BCBB in-vitro COc1ccc([N+](=O)[O-])c2nc(N)nn12 888084665 VVDXPODJHUWZCM-UHFFFAOYSA-N 209.165 0.228 5 40 BCBB N=C(N)NCCCOc1ccc([N+](=O)[O-])cc1 1746396 JGRLPNAYPZAXFS-UHFFFAOYSA-N 238.247 0.847 5 40 BCBB NOCc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 2565867 XWTZKAKUNNFAHY-UHFFFAOYSA-N 213.149 0.893 5 40 BCBB O=[N+]([O-])c1[nH]cnc1C1=NC(=S)N=N1 4476006 YPMPRXLWSJXBJE-UHFFFAOYSA-N 210.178 0.815 5 40 BCBB COc1c([N+](=O)[O-])cc(C(N)=O)cc1[N+](=O)[O-] 26508457 VYKUTLAZAFCVFS-UHFFFAOYSA-N 241.159 0.611 5 40 BCBB CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1F 42265998 NTASCMHCIVCMMS-UHFFFAOYSA-N 234.208 0.642 5 40 BCBB O=[N+]([O-])c1cc(F)ccc1-n1cnnn1 6321227 JXGFNMCVMROOHX-UHFFFAOYSA-N 209.140 0.710 5 40 BCBB O=[N+]([O-])c1nn(CCCO)cc1Cl 12357736 YUZNALJCKKGKDV-UHFFFAOYSA-N 205.601 0.827 5 40 BCBB COc1coc([C@@H](O)[C@H](C)[N+](=O)[O-])cc1=O 480705 VLNFWBYJEHFZAB-CDUCUWFYSA-N 229.188 0.347 5 40 BCBB C[C@H]1NNC(=O)[C@@H]1c1ccc([N+](=O)[O-])cc1 1701996 UCVOGOBPJUGZJL-MUWHJKNJSA-N 221.216 0.701 5 40 BCBB O=C(O)c1ccc([N+](=O)[O-])c(P(=O)(O)O)c1 1870312 PWPIHQZKGQOGKL-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB in-vitro Cn1cnc([N+](=O)[O-])c1Sc1ncn[nH]1 15858154 YUPUITJUYVPDSP-UHFFFAOYSA-N 226.221 0.598 5 40 BCBB Cn1cc([N+](=O)[O-])c(OCC(F)F)n1 95098485 KXTCMXNXQIJASR-UHFFFAOYSA-N 207.136 0.972 5 40 BCBB NC(=O)c1cn(-c2ccc([N+](=O)[O-])cc2)cn1 91482230 VEXHPWKKGFCMIM-UHFFFAOYSA-N 232.199 0.879 5 40 BCBB CC(C)(C)N1COC[C@@](CO)([N+](=O)[O-])C1 19798254 XVHGCUHMCSFWJS-SECBINFHSA-N 218.253 0.082 5 40 BCBB O=C(NC1CCSCC1)[C@@H]1C[C@H]1[N+](=O)[O-] 58421733 CLMRYXYJZAZDJN-HTQZYQBOSA-N 230.289 0.663 5 40 BCBB C[C@H](N)C(=O)N(C)Cc1ccc([N+](=O)[O-])cc1 79420896 AWPQDCDEPRNHHI-QMMMGPOBSA-N 237.259 0.900 5 40 BCBB Cc1cc(P(=O)(O)O)ccc1[N+](=O)[O-] 1870302 XBCISKBYPDYYIS-UHFFFAOYSA-N 217.117 0.706 5 40 BCBB NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1 3263628 GGAVNGPANVMTPG-UHFFFAOYSA-N 224.172 0.237 5 40 BCBB CN(C)c1nc2ccccn2c(=O)c1[N+](=O)[O-] 44907178 XNYCMIKXSZEEAD-UHFFFAOYSA-N 234.215 0.669 5 40 BCBB Cn1nc([N+](=O)[O-])cc1CN1CCCC1 685936706 RQVNPPZYWVLNRH-UHFFFAOYSA-N 210.237 0.924 5 40 BCBB Nc1ncn2c(n1)nc(=O)c1ccccc12 19819810 QDBCWDURFINQMG-UHFFFAOYSA-N 213.200 0.220 5 40 BCBB CN(CC1CC1)c1ncc([N+](=O)[O-])c(N)n1 48565865 CXGDZEDRLCIXAQ-UHFFFAOYSA-N 223.236 0.813 5 40 BCBB CCCn1cc([N+](=O)[O-])c(C(=O)OC)n1 408716123 JDDPXPPPKXWQAA-UHFFFAOYSA-N 213.193 0.988 5 40 BCBB NC1=NN(c2cccc([N+](=O)[O-])c2)C(=O)C1 16399903 AYSBNBZKWILQGH-UHFFFAOYSA-N 220.188 0.604 5 40 BCBB CCn1cc(-c2nnc(N)s2)c([N+](=O)[O-])n1 408717644 LVZWAWVGYQJOCM-UHFFFAOYSA-N 240.248 0.912 5 40 BCBB Cc1cc([N+](=O)[O-])nn1C(C)(C)C(=O)O 2535183 AJIFYLKLOXNUNG-UHFFFAOYSA-N 213.193 0.919 5 40 BCBB COC[C@H](O)Cn1cc([N+](=O)[O-])nc1C 13282289 JXMRDOOWRDWKJG-SSDOTTSWSA-N 215.209 0.107 5 40 BCBB CN(C)C(=O)CN(C)c1ccc([N+](=O)[O-])cn1 23296177 PCMAHPOMONJLQI-UHFFFAOYSA-N 238.247 0.514 5 40 BCBB COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cn2)n1 12397851 FGGLDYHYJNHVJK-UHFFFAOYSA-N 248.198 0.962 5 40 BCBB NCc1ccc([C@H]2CNC(=O)C2)c([N+](=O)[O-])c1 199775794 SJEVUPANEHLLNL-MRVPVSSYSA-N 235.243 0.657 5 40 BCBB N[C@@H]1CC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O 20791560 UZSPTZBSWXIJBI-MRVPVSSYSA-N 235.199 0.185 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c([N+](=O)[O-])cc1CO 100116971 BPNHTEMKNUBRFW-UHFFFAOYSA-N 243.131 0.904 5 40 BCBB NC[C@@H](O)COc1ccc([N+](=O)[O-])cc1 22174050 KPZYZMIPQWYOMC-MRVPVSSYSA-N 212.205 0.293 5 40 BCBB CS(=O)(=O)c1ccc(NN)c([N+](=O)[O-])c1 4582915 ITGMYWCBISPNSC-UHFFFAOYSA-N 231.233 0.284 5 40 BCBB O=[N+]([O-])C(CO)(CO)Cc1ccc(F)cc1 52514000 MJEGRTSDJHPPLJ-UHFFFAOYSA-N 229.207 0.368 5 40 BCBB CON(C)S(=O)(=O)c1cccc([N+](=O)[O-])c1 70243247 JOAGQMBLCKEQJJ-UHFFFAOYSA-N 246.244 0.777 5 40 BCBB CN1C(=O)Cc2ccc([N+](=O)[O-])cc2C1=O 256052596 NYAPTEKPHTUVJC-UHFFFAOYSA-N 220.184 0.750 5 40 BCBB O=[N+]([O-])c1c[nH]nc1-c1n[nH]cc1[N+](=O)[O-] 5613369 PUAXQLNEVUEURA-UHFFFAOYSA-N 224.136 0.616 5 40 BCBB CN1CC(=O)Nc2ccc([N+](=O)[O-])cc2C1=O 6857237 SNRRKCPVXFFFKC-UHFFFAOYSA-N 235.199 0.619 5 40 BCBB O=c1[nH]c2c(c(O)c1[N+](=O)[O-])CCCC2 199173663 JODWMMXXVZOUJQ-UHFFFAOYSA-N 210.189 0.868 5 40 BCBB c1ccc2c(c1)cc1c3nnnn3ncn21 1572605 AUFMPWLMIBDHTA-UHFFFAOYSA-N 210.200 0.925 5 40 BCBB O=C(O)COc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 1597111 OWEDBRWCJFWVFZ-UHFFFAOYSA-N 242.143 0.966 5 40 BCBB O=C1C=C[C@H](O)N1c1ccc([N+](=O)[O-])cc1 199414870 UKJLFJHXHQTPQG-VIFPVBQESA-N 220.184 0.816 5 40 BCBB CCC1(C[N+]2(C)CCOCC2)COC1 67350935 KFVNHBOUJTVYTR-UHFFFAOYSA-N 200.302 0.890 5 40 BCBB NCCNc1c(C(=O)O)cccc1[N+](=O)[O-] 6667045 BWRXJVGKSNXVJG-UHFFFAOYSA-N 225.204 0.664 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H](CO)C1 29162951 BWULCCCSWTXZCI-MRVPVSSYSA-N 240.263 0.537 5 40 BCBB Cn1ncnc1NC(=O)c1cccc([N+](=O)[O-])c1 84304051 ICQOKPYMMKQVMH-UHFFFAOYSA-N 247.214 0.976 5 40 BCBB COc1cc2c(cc1[N+](=O)[O-])CNC2=O 238389374 RRPPTAPXRLHCBP-UHFFFAOYSA-N 208.173 0.847 5 40 BCBB O=[N+]([O-])c1cc(I)n[nH]1 299890325 XTRLJYUXTRJDGT-UHFFFAOYSA-N 238.972 0.923 5 40 BCBB O=[N+]([O-])c1ccc(C[C@@H]2CNCCN2)cc1 68604920 LMAMVUGRWPOOJZ-SNVBAGLBSA-N 221.260 0.699 5 40 BCBB CC(=O)Nc1ccc(OCCO)c([N+](=O)[O-])c1 71789959 BKDUSJRNVDOBMP-UHFFFAOYSA-N 240.215 0.924 5 40 BCBB O=[N+]([O-])c1cn(CCOC[C@@H]2CCCO2)cn1 78958668 YXYXTYKKRWMEGW-VIFPVBQESA-N 241.247 0.987 5 40 BCBB CCOC(=O)c1cn(CC(=O)O)nc1[N+](=O)[O-] 408717140 WEIMMPKFYGLXOJ-UHFFFAOYSA-N 243.175 0.053 5 40 BCBB CC(=O)Nc1nc(C)c([N+](=O)[O-])c(O)n1 96330848 FTUUKELCLGAATN-UHFFFAOYSA-N 212.165 0.357 5 40 BCBB NC(=O)COC(=O)c1ccc([N+](=O)[O-])s1 3286342 CWJCYKATEFOVJF-UHFFFAOYSA-N 230.201 0.298 5 40 BCBB CS(=O)(=O)C[C@H](O)c1cccc([N+](=O)[O-])c1 95095244 SPBKGSCWEBWNNZ-VIFPVBQESA-N 245.256 0.673 5 40 BCBB O=C1[C@@H](n2cc([N+](=O)[O-])cn2)CCN1C1CC1 96496790 DKSJWTWYHHBPNR-VIFPVBQESA-N 236.231 0.727 5 40 BCBB CCS(=O)(=O)CCn1nc([N+](=O)[O-])cc1C 184767174 YDNBYKVLXAWYRH-UHFFFAOYSA-N 247.276 0.534 5 40 BCBB Nc1nnc(OCc2cccc([N+](=O)[O-])c2)[nH]1 225970388 YUJCNRFLGTWJRZ-UHFFFAOYSA-N 235.203 0.874 5 40 BCBB CC(C)(C)S(=O)(=O)C[N+]1(C)CCOCC1 1568285 CATUUZLBKGCRLW-UHFFFAOYSA-N 236.357 0.634 5 40 BCBB Nc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 4149469 IFKPUFQFRKLTGD-UHFFFAOYSA-N 223.148 0.962 5 40 BCBB O=[N+]([O-])c1ccccc1-n1cc(CO)nn1 52221036 OVNDJZXXJMEAOJ-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB Nc1nc(=O)n2c(=O)c3ccccc3sc2n1 504397 BZWXKGBISPUXKN-UHFFFAOYSA-N 246.251 0.247 5 40 BCBB O=c1cc(Nc2ccc([N+](=O)[O-])cc2)[nH]c(=O)[nH]1 4046587 DPECUKBLFXDXTG-UHFFFAOYSA-N 248.198 0.715 5 40 BCBB O=c1[nH]c2cc(Cl)c([N+](=O)[O-])cc2[nH]c1=O 13743976 IPRFZVQSFKXGGH-UHFFFAOYSA-N 241.590 0.778 5 40 BCBB COC(=O)CSc1nn(C)cc1[N+](=O)[O-] 95098566 PFDDPVBAUJSJLS-UHFFFAOYSA-N 231.233 0.593 5 40 BCBB O=C(Cn1nnc([N+](=O)[O-])n1)c1ccccc1 98368 GFENDONDSDHSFB-UHFFFAOYSA-N 233.187 0.464 5 40 BCBB NS(=O)(=O)Oc1ccc([N+](=O)[O-])cc1 13440981 OLTVRSUIOUTBRQ-UHFFFAOYSA-N 218.190 0.177 5 40 BCBB Cc1cc([N+](=O)[O-])cnc1N1CC[C@@H](O)C1 61707599 JXQNXBMNNKOLDW-SECBINFHSA-N 223.232 0.869 5 40 BCBB C[C@@H]1CN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 59268615 IPKIIZQGCWXJFM-PVSHWOEXSA-N 242.256 0.988 5 40 BCBB O=C(O)c1c([N+](=O)[O-])cnn1CCF 95098603 RUFBKZYXNKISJS-UHFFFAOYSA-N 203.129 0.459 5 40 BCBB O=c1cc(Cc2ccc([N+](=O)[O-])cc2)[nH]c(=O)[nH]1 1686056 RYGSUUWJGGBEFX-UHFFFAOYSA-N 247.210 0.562 5 40 BCBB CNC(=O)NCCn1c([N+](=O)[O-])cnc1C 20030979 MEVSBCIUCJWBKA-UHFFFAOYSA-N 227.224 0.029 5 40 BCBB O=[N+]([O-])C[C@@]12O[C@@]3(O)[C@@H]4[C@@H]5[C@H]([C@@H]6C[C@H]5[C@@H]3[C@@H]61)[C@@H]42 104023749 LOEIDFUDZVQDTE-LLXSZCENSA-N 235.239 0.108 5 40 BCBB CC(C)N(C)c1ncc([N+](=O)[O-])c(N)n1 69893525 HGYKFVBBSMRTRN-UHFFFAOYSA-N 211.225 0.812 5 40 BCBB Cn1cc([N+](=O)[O-])cc1C(=O)N1CCC1 32845255 BKUGCGNOXJENRA-UHFFFAOYSA-N 209.205 0.779 5 40 BCBB CC(C)[C@H](Nc1ccc([N+](=O)[O-])cn1)C(N)=O 95427451 WUKZFCMDFSMOHY-VIFPVBQESA-N 238.247 0.912 5 40 BCBB Nc1ncnc(N2CCCCC2)c1[N+](=O)[O-] 4126562 MXSKNECAWCKBNI-UHFFFAOYSA-N 223.236 0.957 5 40 BCBB Cc1cc([N+](=O)[O-])cnc1N1CCNCC1 36226185 YFLHJNIWMUZYAG-UHFFFAOYSA-N 222.248 0.708 5 40 BCBB O=C(O)c1cnn(-c2ccc([N+](=O)[O-])cn2)c1 12395488 RKFUNTVOSNYPMG-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB C[N+](C)(C)CCOC(=O)CCCCCN 1677412 GYXYNWGBMPSLNP-UHFFFAOYSA-N 217.333 0.755 5 40 BCBB Cn1ncc([N+](=O)[O-])c1N1CCOCC1 4014794 WWTLGXFIHWUSOO-UHFFFAOYSA-N 212.209 0.165 5 40 BCBB Cc1cc(S(N)(=O)=O)ccc1[N+](=O)[O-] 43570184 VYNKVFONHWQCBK-UHFFFAOYSA-N 216.218 0.551 5 40 BCBB in-vitro O=C(O)c1nn(CCF)cc1[N+](=O)[O-] 95098592 IQRXLNGQQYOCOQ-UHFFFAOYSA-N 203.129 0.459 5 40 BCBB CCOC(=O)c1nn(CC)cc1[N+](=O)[O-] 148722426 GFYIBUKNGZGYLW-UHFFFAOYSA-N 213.193 0.988 5 40 BCBB C[C@H](O)[C@@H]([N+](=O)[O-])[C@@](C)(O)Br 3956697 MQHAOXSTVZHBGN-VPENINKCSA-N 228.042 0.116 5 40 BCBB O=[N+]([O-])c1ccc(N2CC[C@@H](CO)C2)nc1 51886338 WNXFFTGFJKWNPT-MRVPVSSYSA-N 223.232 0.808 5 40 BCBB O=c1c[n+](-c2ccc([N+](=O)[O-])cc2)[nH]o1 6536257 RKAKVBXADCSTLE-UHFFFAOYSA-O 208.153 0.153 5 40 BCBB COc1nc(OC)c([N+](=O)[O-])c(OC)n1 14983681 XAKMRDXCQFULLE-UHFFFAOYSA-N 215.165 0.411 5 40 BCBB Cc1nc([N+](=O)[O-])cn1Cc1nnc(N)s1 1065220 CMQLQZUEMSAGST-UHFFFAOYSA-N 240.248 0.582 5 40 BCBB CC(=O)Nc1cc2c(c([N+](=O)[O-])c1)OC[C@H]2O 66091332 ZQXSJZQVPYEGML-SECBINFHSA-N 238.199 0.979 5 40 BCBB NCCNc1ccc([N+](=O)[O-])c(NCCO)c1 4046668 NZVISMNKEXWNQN-UHFFFAOYSA-N 240.263 0.370 5 40 BCBB COC(=O)c1nn(CC(F)F)cc1[N+](=O)[O-] 408715799 DVSWPUBMKUKBMV-UHFFFAOYSA-N 235.146 0.843 5 40 BCBB C[n+]1c2ccccc2[n+]2[nH]c3ccccc3n12 16248987 ZMNICSIMJSXCPI-UHFFFAOYSA-O 224.267 0.984 5 40 BCBB Cc1c(Cl)c([N+](=O)[O-])nn1CCN 20313044 FNBKZNSKVGGPKR-UHFFFAOYSA-N 204.617 0.712 5 40 BCBB COCCNc1nn(C)cc1[N+](=O)[O-] 95098526 MORZMBHEOCRLOX-UHFFFAOYSA-N 200.198 0.387 5 40 BCBB O=[N+]([O-])c1cn(O)c(-c2ccccc2)[n+]1[O-] 5604583 SOYIQESMXQOKAR-UHFFFAOYSA-N 221.172 0.934 5 40 BCBB CCOC(=O)Cn1c([N+](=O)[O-])cnc1C 289546 CKGGIKOPFUMXET-UHFFFAOYSA-N 213.193 0.663 5 40 BCBB Cc1nn([C@H](C)C(N)=O)c(C)c1[N+](=O)[O-] 2618836 VUNZBLOCMHYYFO-ZCFIWIBFSA-N 212.209 0.454 5 40 BCBB CON[S@](=O)c1ccc([N+](=O)[O-])cc1 5063071 QZBYTLBYMFVRBZ-AWEZNQCLSA-N 216.218 0.768 5 40 BCBB CN1C(=O)COc2cccc([N+](=O)[O-])c21 44676187 PYYOOGDTJRYZBP-UHFFFAOYSA-N 208.173 0.950 5 40 BCBB O=C(NC[C@H]1CO1)c1ccc([N+](=O)[O-])cc1 95096841 NWKRPNJDIPQMHG-VIFPVBQESA-N 222.200 0.723 5 40 BCBB C[C@@H](C(=O)N1CCCC1)n1cc([N+](=O)[O-])cn1 4686648 BVFSTJQZSRJYPT-QMMMGPOBSA-N 238.247 0.975 5 40 BCBB Cn1nnnc1Sc1ncccc1[N+](=O)[O-] 7785172 NVAZHSPQTCJCNY-UHFFFAOYSA-N 238.232 0.665 5 40 BCBB COC(=O)[C@@]1(c2ccc([N+](=O)[O-])cc2)C=CNN1 16125260 PAGXWYRZBXHOKK-NSHDSACASA-N 249.226 0.585 5 40 BCBB O=[N+]([O-])c1ccc(F)cc1S(=O)(=O)O 22116096 KPWHHDVNRKIFRI-UHFFFAOYSA-N 221.165 0.981 5 40 BCBB NCC(=O)NCc1cccc([N+](=O)[O-])c1 52943184 UZOCMSVGFYMDTJ-UHFFFAOYSA-N 209.205 0.170 5 40 BCBB COC(=O)C1CN(c2ncccc2[N+](=O)[O-])C1 95704891 OFSFWWYBFLAPLR-UHFFFAOYSA-N 237.215 0.599 5 40 BCBB Nc1nn(CC(F)(F)F)cc1[N+](=O)[O-] 1548918915 PMEUKLPMYOWYFR-UHFFFAOYSA-N 210.115 0.936 5 40 BCBB O=[N+]([O-])c1ccc(-c2nnn[nH]2)c(F)c1 40350589 VRNHOEYFQWBLOV-UHFFFAOYSA-N 209.140 0.914 5 40 BCBB Cc1nc(N[C@H]2COC[C@@H]2O)ccc1[N+](=O)[O-] 95990617 JSHLXXSVGBVWNB-CBAPKCEASA-N 239.231 0.470 5 40 BCBB CCN(CC)c1ncnc(N)c1[N+](=O)[O-] 4059591 VHGBFAJYLRVZEM-UHFFFAOYSA-N 211.225 0.813 5 40 BCBB CNc1cc([N+](=O)[O-])c([N+](=O)[O-])cc1C(N)=O 225728019 YHOZNZXKNZSXSJ-UHFFFAOYSA-N 240.175 0.644 5 40 BCBB O=C1Nc2ccccc2[C@@]1(O)C[N+](=O)[O-] 503911 LXHQTPGTMXKWEY-VIFPVBQESA-N 208.173 0.103 5 40 BCBB O=C(O)c1cnnn1-c1ccccc1[N+](=O)[O-] 49826181 JDZMNIXOOCNSFG-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB Cc1cn(C(C)(C)C(=O)O)nc1[N+](=O)[O-] 242648961 RMWAGQVCIRQUFK-UHFFFAOYSA-N 213.193 0.919 5 40 BCBB O=C(O)CCn1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918627 BDCUMZPAAJDMRD-UHFFFAOYSA-N 230.136 0.174 5 40 BCBB Cc1nn(C)c(C(=O)n2cccn2)c1[N+](=O)[O-] 2762895 YCWLPGMMRASXNX-UHFFFAOYSA-N 235.203 0.522 5 40 BCBB O=C1c2ccccc2C(=O)N1CCC[N+](=O)[O-] 32199147 CRXXTBGPVDVHPD-UHFFFAOYSA-N 234.211 0.949 5 40 BCBB CCc1c([N+](=O)[O-])c(C(=O)O)nn1CCOC 95096604 MZWZLQCQLRGGEK-UHFFFAOYSA-N 243.219 0.698 5 40 BCBB O=[N+]([O-])C[C@]12O[C@@]3(O)[C@@H]4[C@@H]5[C@@H]([C@@H]41)[C@H]1C[C@H]5[C@@H]3[C@@H]12 104023741 LOEIDFUDZVQDTE-QWGGRZFRSA-N 235.239 0.108 5 40 BCBB CCOC(=O)Nc1cc(=O)c([N+](=O)[O-])c(N)[nH]1 5479026 OOQZAYBEVLRMEG-UHFFFAOYSA-N 242.191 0.434 5 40 BCBB N[C@H](CC(=O)O)c1ccc(O)c([N+](=O)[O-])c1 44196795 DVXMODFUHCVXIE-ZCFIWIBFSA-N 226.188 0.775 5 40 BCBB Cc1cc(C)n(C(=O)c2nn(C)cc2[N+](=O)[O-])n1 37186 SJFHBSIAJCQSBZ-UHFFFAOYSA-N 249.230 0.830 5 40 BCBB COC(=O)[C@@H](O)c1ccccc1[N+](=O)[O-] 3846260 FIPPVJRVIBXUJD-QMMMGPOBSA-N 211.173 0.801 5 40 BCBB biogenic CNCC(=O)Nc1cccc([N+](=O)[O-])c1 26513829 OROYIUNPGZBOTP-UHFFFAOYSA-N 209.205 0.753 5 40 BCBB Cc1ccc(C(=O)OCC(N)=O)cc1[N+](=O)[O-] 3511539 NANDQQKLONTKBI-UHFFFAOYSA-N 238.199 0.545 5 40 BCBB CCONC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 11642290 SQGLOPAKEFTTQN-UHFFFAOYSA-N 242.235 0.476 5 40 BCBB CN(N)c1ncc(Cl)cc1[N+](=O)[O-] 199546184 SVRWTPGTUZRWJO-UHFFFAOYSA-N 202.601 0.953 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c2no[n+]([O-])c2c1 4953464 YHBBUAULQKLKMW-UHFFFAOYSA-N 226.104 0.278 5 40 BCBB NC(=O)[C@@H]1CCCN1c1ncccc1[N+](=O)[O-] 23623513 IUJOMOBBAZFJLP-ZETCQYMHSA-N 236.231 0.444 5 40 BCBB Nc1nc(NC[C@H]2CCCO2)ncc1[N+](=O)[O-] 48543843 VJNKQRYHFPYUHG-ZCFIWIBFSA-N 239.235 0.558 5 40 BCBB Cn1ncc(-c2nnc(N)s2)c1[N+](=O)[O-] 408717582 IVIHKRBNFTUDPY-UHFFFAOYSA-N 226.221 0.429 5 40 BCBB Cc1noc(C)c1Cn1cnc([N+](=O)[O-])n1 48367821 KOZHTSQVTIDNIA-UHFFFAOYSA-N 223.192 0.839 5 40 BCBB Nc1nnc2c3ccccc3ccc2[n+]1[O-] 65009 USRABTCONLMHII-UHFFFAOYSA-N 212.212 0.999 5 40 BCBB C[C@H](O)[C@H]([N+](=O)[O-])[C@@](C)(O)Br 3956695 MQHAOXSTVZHBGN-VAYJURFESA-N 228.042 0.116 5 40 BCBB CCOC(=O)CSc1[nH]ncc1[N+](=O)[O-] 16971321 NYGWWAPASWSTAH-UHFFFAOYSA-N 231.233 0.973 5 40 BCBB CON(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N 48299209 ATBHYTWGKJBCIC-UHFFFAOYSA-N 243.194 0.950 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])nn1C(F)F 408715484 SIDMLEHOSZFIHH-UHFFFAOYSA-N 221.119 0.973 5 40 BCBB CNC(=O)CNc1ccccc1[N+](=O)[O-] 7270752 SNTFJBKVMVKOEY-UHFFFAOYSA-N 209.205 0.753 5 40 BCBB O=[N+]([O-])c1ccc(CN(CCO)CCO)cc1 14983368 DNMSRNDFJOWEQS-UHFFFAOYSA-N 240.259 0.381 5 40 BCBB NS(=O)(=O)c1ccc([N+](=O)[O-])cc1F 48440905 ZQRIWZZRAVYMHQ-UHFFFAOYSA-N 220.181 0.381 5 40 BCBB in-vitro Nc1c([N+](=O)[O-])nc(Cl)c2nncn12 5812378 ZFLXGYCPGIXCRA-UHFFFAOYSA-N 214.572 0.268 5 40 BCBB CONC(=O)Cc1ccccc1[N+](=O)[O-] 25823235 MYTCINDPCUHCJS-UHFFFAOYSA-N 210.189 0.815 5 40 BCBB O=C(O)/C=C/C(=O)Nc1ccc([N+](=O)[O-])cn1 4457766 QHJUXQQQLBCREG-ONEGZZNKSA-N 237.171 0.569 5 40 BCBB Nc1cn(CC(F)(F)F)nc1[N+](=O)[O-] 1548918878 MBKKZMRBKGUCJF-UHFFFAOYSA-N 210.115 0.936 5 40 BCBB C[N+]1([C@@H]2CCS(=O)(=O)C2)CCCCC1 8299271 UMHRCNLJXONEHO-SNVBAGLBSA-N 218.342 0.804 5 40 BCBB CCn1nc([N+](=O)[O-])cc1-c1nnc(N)s1 408717597 JQTWMPKYIOVDPQ-UHFFFAOYSA-N 240.248 0.912 5 40 BCBB O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCO 2006144 UCNWGARSYXRADB-SNAWJCMRSA-N 236.227 0.717 5 40 BCBB C[C@H](Oc1ccccc1[N+](=O)[O-])C(N)=O 5109312 KANYHDSBWVYJSD-LURJTMIESA-N 210.189 0.847 5 40 BCBB Cc1nn(CC(=O)NC2CC2)c(C)c1[N+](=O)[O-] 7735305 CXMOUYNWCFTNIO-UHFFFAOYSA-N 238.247 0.687 5 40 BCBB CC(=O)Nc1ccc([N+](=O)[O-])cc1-c1nnn[nH]1 4837360 NDVZNDDIDXEKBG-UHFFFAOYSA-N 248.202 0.733 5 40 BCBB O=C(O)Cn1nc(C(F)(F)F)cc1[N+](=O)[O-] 35655541 FCALAZJCUNJLNC-UHFFFAOYSA-N 239.109 0.895 5 40 BCBB CC(=O)Nc1cc(C(N)=O)cc([N+](=O)[O-])c1 4181850 PTRITMACUSKMHQ-UHFFFAOYSA-N 223.188 0.652 5 40 BCBB C[C@@H](C(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918824 IWHXZHCGXBACRM-VKHMYHEASA-N 230.136 0.345 5 40 BCBB O=[N+]([O-])C1=C[C@H]2NSN[C@H]2c2nsnc21 5382418 OXLXAZUXEVCWBI-VVJJHMBFSA-N 243.273 0.335 5 40 BCBB CN(C)S(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 7374395 JNBSDOVFCHSPJE-UHFFFAOYSA-N 248.235 0.984 5 40 BCBB Cc1ccc([SH](=O)=O)cc1[N+](=O)[O-] 12577468 JDIBSIYIPMVSBR-UHFFFAOYSA-N 201.203 0.874 5 40 BCBB CC[C@H](CO)Nc1ncc([N+](=O)[O-])c(N)n1 62022627 AKZLSWXGYBUTOL-RXMQYKEDSA-N 227.224 0.150 5 40 BCBB NC(=O)NC(=O)Cc1ccc([N+](=O)[O-])cc1 1729600 AGDWMWXDXXWYEZ-UHFFFAOYSA-N 223.188 0.332 5 40 BCBB CC(=O)NCCCNc1ncccc1[N+](=O)[O-] 29530669 CICGGFXVJRPJMW-UHFFFAOYSA-N 238.247 0.928 5 40 BCBB CCCNC(=O)c1nn(C)cc1[N+](=O)[O-] 2740176 NNPOQOYJUIFJNA-UHFFFAOYSA-N 212.209 0.468 5 40 BCBB COC(=O)[C@@H](C)Nc1ncccc1[N+](=O)[O-] 34287080 UQMSOGUSOHTFKN-ZCFIWIBFSA-N 225.204 0.963 5 40 BCBB in-vitro CC[C@](C)(NC(=O)[C@H]1C[C@@H]1[N+](=O)[O-])C(=O)OC 65476005 KJECIIZOKMHFCI-BYULHYEWSA-N 244.247 0.110 5 40 BCBB CCOc1n[n+]([O-])c(Cl)cc1[N+](=O)[O-] 1566756 QRZFQGWLAPXNDS-UHFFFAOYSA-N 219.584 0.675 5 40 BCBB Cn1cc([N+](=O)[O-])c(C(=O)N2CCCC2)n1 2807397 DFHMXZOTKURVJA-UHFFFAOYSA-N 224.220 0.564 5 40 BCBB Nc1nc(NC[C@@H]2CCCO2)ncc1[N+](=O)[O-] 48543842 VJNKQRYHFPYUHG-LURJTMIESA-N 239.235 0.558 5 40 BCBB C[C@H](CO)N(C)c1ccc([N+](=O)[O-])nc1 95449495 ZOCVFMOIKBRSAQ-SSDOTTSWSA-N 211.221 0.807 5 40 BCBB NNc1ccc([N+](=O)[O-])c2n[nH]c(O)c12 102884516 PUWMGMYFGMMEHU-UHFFFAOYSA-N 209.165 0.462 5 40 BCBB Cc1c(Cl)c([N+](=O)[O-])nn1[N+](=O)[O-] 5749076 TWUJTPBZGVVZGV-UHFFFAOYSA-N 206.545 0.793 5 40 BCBB NC(=O)Cc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1 71404990 NSJBFLBVZZQINS-UHFFFAOYSA-N 241.159 0.236 5 40 BCBB NC(=O)N[C@H](C(=O)O)c1ccccc1[N+](=O)[O-] 71602880 LTRMBSQYWCCNEI-ZETCQYMHSA-N 239.187 0.389 5 40 BCBB CC1OCC(Br)([N+](=O)[O-])CO1 1482115 VFBSFSGHILWWIJ-UHFFFAOYSA-N 226.026 0.747 5 40 BCBB in-man Cc1cc(C(N)=O)c([N+](=O)[O-])cc1[N+](=O)[O-] 3163561 NZRLXNWSNPDHOC-UHFFFAOYSA-N 225.160 0.910 5 40 BCBB C[C@@H]1NNC(=O)[C@@H]1c1ccc([N+](=O)[O-])cc1 1701995 UCVOGOBPJUGZJL-RCOVLWMOSA-N 221.216 0.701 5 40 BCBB CN1C(=O)C(=O)c2cc([N+](=O)[O-])ccc21 4141329 JPTDPTOWOMFBRY-UHFFFAOYSA-N 206.157 0.754 5 40 BCBB in-vitro O=C(O)CNc1ccc(C(=O)O)cc1[N+](=O)[O-] 12249672 NJQUVBKOFPHRSE-UHFFFAOYSA-N 240.171 0.790 5 40 BCBB CONC(=O)c1ccc([N+](=O)[O-])s1 24835578 JMDPIKXVNRXSFA-UHFFFAOYSA-N 202.191 0.948 5 40 BCBB Cc1nc(N[C@H]2COC[C@H]2O)ccc1[N+](=O)[O-] 95990619 JSHLXXSVGBVWNB-IONNQARKSA-N 239.231 0.470 5 40 BCBB Cc1n[nH]c(=O)c2cc3c(C)n[nH]c(=O)c3cc12 52580 HKGXDXJMXZTGQE-UHFFFAOYSA-N 242.238 0.776 5 40 BCBB COc1cc([C@@H](N)C(=O)O)cc([N+](=O)[O-])c1O 199810321 IMVTYNWRCKFQLQ-SSDOTTSWSA-N 242.187 0.393 5 40 BCBB Cc1cc(OC(=O)C2CC2)c([N+](=O)[O-])c(=O)[nH]1 13523189 ZXFVDCOQCNJEHS-UHFFFAOYSA-N 238.199 0.907 5 40 BCBB CC[N+](C)(CC)[C@@H]1CCS(=O)(=O)C1 6168606 UWWHYKPUCJQOSU-SECBINFHSA-N 206.331 0.660 5 40 BCBB NC(=O)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1 45953427 ASTWLUNEGHPCRN-ZETCQYMHSA-N 249.226 0.433 5 40 BCBB O=C(O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O 3358619 ZWIZJEAIFPFNRX-UHFFFAOYSA-N 249.182 0.389 5 40 BCBB NC(=O)c1ccc(Cn2ccnc2)c([N+](=O)[O-])c1 10809874 KWELGNTZSKBMEI-UHFFFAOYSA-N 246.226 0.939 5 40 BCBB CN(C)/C=C/c1nnc([N+](=O)[O-])s1 73351350 VMVKEXPTGFUUTD-ONEGZZNKSA-N 200.223 0.979 5 40 BCBB CNC(=O)[C@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 97237948 UZTDXQJCRYBYKM-SNVBAGLBSA-N 249.226 0.834 5 40 BCBB CNc1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] 9469660 FBRNTBHJKBEDHG-UHFFFAOYSA-N 220.188 0.873 5 40 BCBB in-vitro Cn1c2nc(=O)[nH]c(=O)c-2cc2ccc(O)cc21 104224914 OUGAIZVGSVJGQB-UHFFFAOYSA-N 243.222 0.432 5 40 BCBB O=[N+]([O-])c1ccc2nc(O)[nH][n+](=O)c2c1 104281425 NUTXYTOWZLHEES-UHFFFAOYSA-O 209.141 0.091 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](CO)C1 29162958 BWULCCCSWTXZCI-QMMMGPOBSA-N 240.263 0.537 5 40 BCBB CC(=O)NCCc1ccc(N)cc1[N+](=O)[O-] 3845784 XASYKQMZEPNRAF-UHFFFAOYSA-N 223.232 0.856 5 40 BCBB biogenic COc1ccc(NCCN)c([N+](=O)[O-])c1 4851824 GCXAFSLQRVODPW-UHFFFAOYSA-N 211.221 0.974 5 40 BCBB CN1C(N)=NC(=O)/C1=C\c1ccc([N+](=O)[O-])cc1 8204516 BODUGPGDRSDSAC-RMKNXTFCSA-N 246.226 0.722 5 40 BCBB Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c([N+](=O)[O-])c1N 100717783 XMVCESAIILNRNQ-UHFFFAOYSA-N 243.135 0.576 5 40 BCBB CC[C@@H](C(=O)O)n1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918812 IMYJABWLMOLFEA-BYPYZUCNSA-N 244.163 0.735 5 40 BCBB NNc1cc(N2CCOCC2)ccc1[N+](=O)[O-] 4741000 VRCIVUOADCQPSV-UHFFFAOYSA-N 238.247 0.717 5 40 BCBB O=C(CO[N+](=O)[O-])c1ccccc1[N+](=O)[O-] 68606035 DJHVEAAJWUJKRG-UHFFFAOYSA-N 226.144 0.986 5 40 BCBB O=C(NO[C@@H]1CCCCO1)[C@H]1C[C@H]1[N+](=O)[O-] 106531414 CDOUWDMTGNDIRM-XLPZGREQSA-N 230.220 0.226 5 40 BCBB Nc1c([N+](=O)[O-])cc([N+](=O)[O-])c(N)c1[N+](=O)[O-] 100043261 FZAZPMLWYUKRAE-UHFFFAOYSA-N 243.135 0.576 5 40 BCBB Cn1nnnc1NCc1cccc([N+](=O)[O-])c1 22109509 KAFQHZHNKXQINK-UHFFFAOYSA-N 234.219 0.730 5 40 BCBB O=C(c1cc([N+](=O)[O-])n[nH]1)N1CCCC1 72209670 SIIVESSDNTUNKD-UHFFFAOYSA-N 210.193 0.554 5 40 BCBB O=[N+]([O-])c1ccc([C@@H]2CNCCN2)cc1 4203755 WWRUGVIJFUXWFW-JTQLQIEISA-N 207.233 0.829 5 40 BCBB Cn1cnc([N+](=O)[O-])c1SCCO 8737863 FXCBACAUWFUWLY-UHFFFAOYSA-N 203.223 0.413 5 40 BCBB COc1ccc(OC)c([N+](=O)[O-])c1C(N)=O 478136 IIVVGIHHLJDOIE-UHFFFAOYSA-N 226.188 0.711 5 40 BCBB NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N 3953366 KTGYSUKUKPGPES-UHFFFAOYSA-N 226.148 0.184 5 40 BCBB O=C(O)c1ccc([N+](=O)[O-])cc1-n1cnnc1 19737412 SPYSHOYBTKCTJC-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB O=c1nc(Nc2ccc([N+](=O)[O-])cc2)[nH]c(=O)[nH]1 4037038 ZROJKVSUKYMKDG-UHFFFAOYSA-N 249.186 0.110 5 40 BCBB O=C1NC(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)N1 13546535 MSTWOYMTYLWAGQ-YVMONPNESA-N 233.183 0.775 5 40 BCBB O=[N+]([O-])C[C@]12O[C@@]3(O)[C@@H]4[C@H]5[C@H]6C[C@H]([C@H]5[C@@H]41)[C@@H]2[C@@H]63 104023730 LOEIDFUDZVQDTE-PCAOIQFPSA-N 235.239 0.108 5 40 BCBB C[C@H](Cn1nc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)O 1548918928 RSYCGEFXWMBSPU-SCSAIBSYSA-N 244.163 0.420 5 40 BCBB Cn1c(=O)n(C)c2nc([N+](=O)[O-])c(Cl)cc21 238567 GEDXIBYRXOWQEW-UHFFFAOYSA-N 242.622 0.834 5 40 BCBB NC(=O)c1ccc(C(=O)O)cc1[N+](=O)[O-] 2526460 LKPGLAHLFCDSNK-UHFFFAOYSA-N 210.145 0.392 5 40 BCBB O=C(O)c1ccn(-c2ncccc2[N+](=O)[O-])n1 12395484 UULIGRUQIULKFD-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB CNc1cc(OC[C@@H](O)CO)ccc1[N+](=O)[O-] 34751539 CDRHDQOGKXFJSA-ZETCQYMHSA-N 242.231 0.369 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])c2c(c1)nnn2C 218257605 NQVBYLNMPYLFFT-UHFFFAOYSA-N 236.187 0.663 5 40 BCBB C[C@@H]1[C@@H](C)N1C[C@H](O)Cn1ccnc1[N+](=O)[O-] 1607781 VKUQQJFQNDTATQ-IWSPIJDZSA-N 240.263 0.245 5 40 BCBB in-vitro NN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 3257501 BKJVLMOHSLXVMX-UHFFFAOYSA-N 207.145 0.065 5 40 BCBB COC(=O)C[C@H](C[N+](=O)[O-])C1CCOCC1 88611521 WJIYWVPGYXYBEV-SECBINFHSA-N 231.248 0.869 5 40 BCBB Nc1ncc([N+](=O)[O-])c(N2CCCCC2)n1 5444460 VXCUIGFLUSTTMR-UHFFFAOYSA-N 223.236 0.957 5 40 BCBB c1ccn2c(c1)nc1nc3nonc3nc12 128137 VYBCDJPSQUSKAA-UHFFFAOYSA-N 212.172 0.814 5 40 BCBB O=c1c(Cl)c(Cl)c([N+](=O)[O-])nn1CO 2561313 MVDWAHGOMODUSN-UHFFFAOYSA-N 240.002 0.408 5 40 BCBB CO[C@@H]([C@H](OC)[N+](C)(C)C)[N+](C)(C)C 3843381 PNXZJSVFTBMPKF-UWVGGRQHSA-N 206.330 0.344 5 40 BCBB Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(N)cc21 6547820 XLOCKKZGCLQUGP-UHFFFAOYSA-N 222.204 0.367 5 40 BCBB CN(C)CCNc1ncccc1[N+](=O)[O-] 8716961 UUOZHSKQCXSUQP-UHFFFAOYSA-N 210.237 0.963 5 40 BCBB Cc1ccc2nc3[nH]c(=O)[nH]c(=O)c3c(N)c2c1 17013713 VJSWEDKWSLMQEC-UHFFFAOYSA-N 242.238 0.655 5 40 BCBB COC(=O)C[C@@H](C[N+](=O)[O-])C1CCOCC1 88611519 WJIYWVPGYXYBEV-VIFPVBQESA-N 231.248 0.869 5 40 BCBB Nc1cc([N+](=O)[O-])c(C(=O)O)c([N+](=O)[O-])c1 2529762 HRBPUPBLMZFYBP-UHFFFAOYSA-N 227.132 0.783 5 40 BCBB CCc1ccc([N+](=O)[O-])cc1S(N)(=O)=O 49392858 VPPRAJUZONSIMH-UHFFFAOYSA-N 230.245 0.805 5 40 BCBB O=[N+]([O-])c1cc([N+](=O)[O-])c(CO)c([N+](=O)[O-])c1 95696934 IFNVWRBEJGYFNL-UHFFFAOYSA-N 243.131 0.904 5 40 BCBB C[C@@H]1CC(=O)[C@@H](CC(=O)O)[C@@H]1C[N+](=O)[O-] 4529339 YPCIKCQPODDZAT-DSYKOEDSSA-N 215.205 0.579 5 40 BCBB biogenic,in-vitro O=[N+]([O-])c1ccc2c(c1)N(CCO)CC2 97374253 YWIURPZRTSSLLK-UHFFFAOYSA-N 208.217 0.950 5 40 BCBB Cn1nc([N+](=O)[O-])c(Cl)c1[N+](=O)[O-] 3894656 VKCXIULUEMQTNL-UHFFFAOYSA-N 206.545 0.890 5 40 BCBB C[C@@H]1C(=O)NCCN1Cc1ccc([N+](=O)[O-])cc1 60377282 OQIXYIQJUDBUIU-SECBINFHSA-N 249.270 0.915 5 40 BCBB Cn1cc([N+](=O)[O-])c(C(=O)n2cccn2)n1 37195 ZWMFRMLVLVDQRQ-UHFFFAOYSA-N 221.176 0.213 5 40 BCBB CCC(=O)O[C](CC(=O)O)C[N+](C)(C)C 1560411754 RZQXHWLNCSRIGZ-UHFFFAOYSA-O 217.265 0.652 5 40 BCBB Nc1c([N+](=O)[O-])cc2[nH]c(O)nc2c1[N+](=O)[O-] 5003738 XNWBTZFWSSSTJO-UHFFFAOYSA-N 239.147 0.667 5 40 BCBB O=[N+]([O-])c1ccc(-n2cc(CO)nn2)cc1 34402270 NIFGKSJKCMZAEF-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 2656422 RKVURLUZPDESNH-SCSAIBSYSA-N 228.160 0.391 5 40 BCBB COC(=O)c1c(O)ccc([N+](=O)[O-])c1O 142967421 VFGXSVIWUUDBSU-UHFFFAOYSA-N 213.145 0.793 5 40 BCBB CN(C)CCC(=O)OCC[N+](C)(C)C 1677408 NLWFFPJHXLKQFT-UHFFFAOYSA-N 203.306 0.188 5 40 BCBB O=[N+]([O-])c1c[nH]c(I)n1 34542971 JMMWLKHHYDGTLC-UHFFFAOYSA-N 238.972 0.923 5 40 BCBB N[C](Cc1ccc([N+](=O)[O-])cc1)C(=O)O 1560405335 HEXCKMCXBSKLTN-UHFFFAOYSA-N 209.181 0.713 5 40 BCBB O=[N+]([O-])c1ccc(S(=O)(=O)O)cc1F 22116091 QHCAHAXGOGJVLY-UHFFFAOYSA-N 221.165 0.981 5 40 BCBB CCOCCn1ncc([N+](=O)[O-])c1N 97082573 BPFXLXVIVUMOPW-UHFFFAOYSA-N 200.198 0.410 5 40 BCBB O=[N+]([O-])c1ccc(-[n+]2nc3nonc3[nH]2)cc1 16429318 MEGMOCJTOCDIMI-UHFFFAOYSA-N 233.167 0.131 5 40 BCBB O=[N+]([O-])c1ccc(NC(CO)CO)cc1 35822777 RMBOXRGPALVRGT-UHFFFAOYSA-N 212.205 0.360 5 40 BCBB O=[N+]([O-])c1cccc(-n2nncc2CO)c1 62262882 ICDHIZCFVOWDIJ-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB C[C@H](O)[C@@H]([N+](=O)[O-])[C@](C)(O)Br 100296223 MQHAOXSTVZHBGN-LMVFSUKVSA-N 228.042 0.116 5 40 BCBB O=[N+]([O-])c1cccc2c1NS(=O)(=O)C2 137869509 IELJSUNBKXYYJX-UHFFFAOYSA-N 214.202 0.850 5 40 BCBB Cc1nn(CC(=O)N(C)C)c(C)c1[N+](=O)[O-] 3328897 BFHMSKPMHBYSNB-UHFFFAOYSA-N 226.236 0.496 5 40 BCBB O=c1[nH]nc(CCNc2ccc([N+](=O)[O-])cc2)[nH]1 79047789 JHJLUPOBXHTDBN-UHFFFAOYSA-N 249.230 0.661 5 40 BCBB O=[N+]([O-])c1ccsc1NC[C@H](O)CO 95986674 FOFKPRNMEBHENM-YFKPBYRVSA-N 218.234 0.421 5 40 BCBB O=[N+]([O-])c1ccccc1-n1nncc1CO 225766771 NYPZVACRBFSFPL-UHFFFAOYSA-N 220.188 0.668 5 40 BCBB O=C1NC(S)=N/C1=C/c1ccc([N+](=O)[O-])o1 176935 FEFMSAZYTGHUJJ-HWKANZROSA-N 239.212 0.944 5 40 BCBB O=[N+]([O-])c1ccc2c(c1)nc(CO)n2CCO 241041 VRBXVDOHKPPUFP-UHFFFAOYSA-N 237.215 0.429 5 40 BCBB COC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc21 59383166 FRTUJLXFMBXRPE-UHFFFAOYSA-N 242.212 0.690 5 40 BCBB C[C@H]1CCN(c2ncc([N+](=O)[O-])c(N)n2)C1 75582057 YHCHFSQVGTWSIE-LURJTMIESA-N 223.236 0.813 5 40 BCBB Cc1ccc(C(=O)NCC(=O)O)cc1[N+](=O)[O-] 81037 FBJVVYJQHFWBDF-UHFFFAOYSA-N 238.199 0.718 5 40 BCBB NC(=O)c1c(N)[nH]c2cc([N+](=O)[O-])c(F)cc12 12505444 XDKKNTPKFHOZAN-UHFFFAOYSA-N 238.178 0.896 5 40 BCBB in-vitro Cc1cc([N+](=O)[O-])ccc1-n1cnnn1 411392 AEAZPRPUFABPGY-UHFFFAOYSA-N 205.177 0.879 5 40 BCBB C[C@@H](N)C(=O)OCc1ccc([N+](=O)[O-])cc1 36602833 YCNGTSKOSZDDTR-SSDOTTSWSA-N 224.216 0.985 5 40 BCBB COc1cc(N(C)C)c([N+](=O)[O-])cc1C(N)=O 45957628 KNVNUZOAFPDMQB-UHFFFAOYSA-N 239.231 0.768 5 40 BCBB CNC(=O)c1cc([N+](=O)[O-])ccc1OC 32579493 WTBGDACJPRQRLG-UHFFFAOYSA-N 210.189 0.963 5 40 BCBB NC(=O)c1nn(CC(F)(F)F)cc1[N+](=O)[O-] 96029586 LEDSOMYVQALJJJ-UHFFFAOYSA-N 238.125 0.453 5 40 BCBB CC(C)([N+](=O)[O-])C(C)([N+](=O)[O-])[N+](=O)[O-] 104037701 PBTUMCNSHBZQLW-UHFFFAOYSA-N 207.142 0.311 5 40 BCBB O=Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)O 1683203 KIHAMCBHCNQCST-UHFFFAOYSA-N 231.185 0.654 5 40 BCBB Cn1nc([N+](=O)[O-])nc1Br 3882486 BILVAFUMOLVWDJ-UHFFFAOYSA-N 206.987 0.486 5 40 BCBB Cn1nnc2cc(C(=O)O)cc([N+](=O)[O-])c21 218257528 DCLKWMNGANBTON-UHFFFAOYSA-N 222.160 0.575 5 40 BCBB CCOc1nnnn1-c1ccc([N+](=O)[O-])cc1 376956 QIHTYYQKQXOKJN-UHFFFAOYSA-N 235.203 0.969 5 40 BCBB CS(=O)(=O)Oc1ccc([N+](=O)[O-])cc1 1759879 FFGGSHSHUKFELB-UHFFFAOYSA-N 217.202 0.933 5 40 BCBB O=C(O)C(Cc1ccc([N+](=O)[O-])cc1)C(=O)O 2505337 LDIKKFOPLVSXKD-UHFFFAOYSA-N 239.183 0.923 5 40 BCBB Cc1cc([N+](=O)[O-])c(S(N)(=O)=O)cc1C 19979594 BXIVAFSTASTHIG-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB O=C(c1ccc([N+](=O)[O-])s1)N1CCNCC1 21952471 UMXPZCMMEGXOTC-UHFFFAOYSA-N 241.272 0.702 5 40 BCBB in-vitro C[C@H](O)C(C)(C)Nc1ncc([N+](=O)[O-])c(N)n1 95447235 JHQAUJDEQXXWCM-YFKPBYRVSA-N 241.251 0.538 5 40 BCBB O=c1cc(O)c2cc3c(O)cc(=O)[nH]c3nc2[nH]1 5338010 MAOCWKCDCXFXKG-UHFFFAOYSA-N 245.194 0.176 5 40 BCBB CC(C)n1cc([N+](=O)[O-])c(CC(=O)O)n1 72209705 SSEKJVZXAVFHTC-UHFFFAOYSA-N 213.193 0.999 5 40 BCBB NS(=O)(=O)c1cc([N+](=O)[O-])c(F)cc1F 22222615 FOVZKBNCWNHINN-UHFFFAOYSA-N 238.171 0.520 5 40 BCBB Cc1ncc([N+](=O)[O-])n1Cc1nnc(N)s1 17107141 OVYDRRUWRUNBCE-UHFFFAOYSA-N 240.248 0.582 5 40 BCBB C[C@](N)(C(=O)O)c1cccc([N+](=O)[O-])c1 41598323 XZQJKUIVACLBNX-SECBINFHSA-N 210.189 0.853 5 40 BCBB in-vitro CONC(=O)COc1cccc([N+](=O)[O-])c1 70283772 GGBFSJCAWRWMRA-UHFFFAOYSA-N 226.188 0.651 5 40 BCBB CC(=O)Cn1nc([N+](=O)[O-])nc1Br 997208 ICBILSDFLPQPBP-UHFFFAOYSA-N 249.024 0.538 5 40 BCBB CCO[C@H]1NCCNc2c([N+](=O)[O-])ncn21 25179087 YFNLWJSMZSZSEA-QMMMGPOBSA-N 227.224 0.299 5 40 BCBB NC(=O)c1cc([N+](=O)[O-])ccc1-n1cccn1 58824560 ZXPLJPDOOCFQLL-UHFFFAOYSA-N 232.199 0.879 5 40 BCBB O=C(O)c1ccc([N+](=O)[O-])c(O)c1[N+](=O)[O-] 16384168 NOYULBGOASQKGQ-UHFFFAOYSA-N 228.116 0.907 5 40 BCBB O=[N+]([O-])c1cnc(N2CCC[C@@H](O)C2)nc1 40455015 AKQVFOYTNARRNP-MRVPVSSYSA-N 224.220 0.346 5 40 BCBB O=[N+]([O-])c1ccc(N[C@@H]2CCNC2)nc1 52093920 IHQXNCLPRLYSSY-SSDOTTSWSA-N 208.221 0.764 5 40 BCBB in-vitro C[N+]12CCC(CC1)[C@@](C#N)(N1CCOCC1)C2 178971 CYCZWAYOSRRYDY-UYJPIKCFSA-N 236.339 0.451 5 40 BCBB NCCNc1ccc([N+](=O)[O-])cc1C(=O)O 4313545 PGIQBPZLZVDGHP-UHFFFAOYSA-N 225.204 0.664 5 40 BCBB O=[N+]([O-])c1ccc(NCS(=O)(=O)O)cc1 4774029 IURDXOSPFRUATL-UHFFFAOYSA-N 232.217 0.852 5 40 BCBB C[C@@](O)(CO)CNc1cc(F)ccc1[N+](=O)[O-] 90287804 SLUKQZJCIQFADY-JTQLQIEISA-N 244.222 0.889 5 40 BCBB CCOC(=O)c1c([N+](=O)[O-])nc(C)n1C 1414611 NTTJVUGCZJOVEI-UHFFFAOYSA-N 213.193 0.813 5 40 BCBB CCNC(=O)COC(=O)c1ccc([N+](=O)[O-])o1 3314745 GLFGTAJUADLZBV-UHFFFAOYSA-N 242.187 0.481 5 40 BCBB CO[C@@H]1CC[C@H](O)[C@H](/C=C/[N+](=O)[O-])C1 5733823 QYXZOFLIRWHLBP-CAFNPDQUSA-N 201.222 0.953 5 40 BCBB Cc1cc(F)c(S(N)(=O)=O)cc1[N+](=O)[O-] 68576765 BTMINKNDRZPUGI-UHFFFAOYSA-N 234.208 0.690 5 40 BCBB in-vitro CCCCNC(=O)Cn1cc([N+](=O)[O-])cn1 5792793 OVIIDULQPVGIDD-UHFFFAOYSA-N 226.236 0.708 5 40 BCBB CNS(=O)(=O)Cc1cccc([N+](=O)[O-])c1 20049902 YQUXHTZFBZPOEH-UHFFFAOYSA-N 230.245 0.644 5 40 BCBB Nc1ccc(NC(=O)c2nc[nH]n2)cc1[N+](=O)[O-] 5394768 VLDJDDTVAGIPHM-UHFFFAOYSA-N 248.202 0.547 5 40 BCBB O=[N+]([O-])c1ccn(CCC2OCCO2)n1 67796671 ISHYNLFBYIDLCD-UHFFFAOYSA-N 213.193 0.554 5 40 BCBB O=[N+]([O-])c1cn(CCOC[C@H]2CCCO2)cn1 78958675 YXYXTYKKRWMEGW-SECBINFHSA-N 241.247 0.987 5 40 BCBB NNCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 84193958 CZWFUCUINKBZGR-UHFFFAOYSA-N 212.165 0.466 5 40 BCBB O=[N+]([O-])/C(CN1CCOCC1)=C1/CCCN1 3189234 XABWRNLRQKHSGV-KTKRTIGZSA-N 227.264 0.190 5 40 BCBB O=C(N=c1[nH]c2ccccc2[nH]1)[C@@H]1C[C@@H]1[N+](=O)[O-] 52555087 MDAXYSKDHYPNTG-MUWHJKNJSA-N 246.226 0.589 5 40 BCBB O=C(O)Cn1cc([N+](=O)[O-])c(C(F)(F)F)n1 2537833 RZRPTHOQEVELMD-UHFFFAOYSA-N 239.109 0.895 5 40 BCBB COC(=O)CNc1ncc(C)cc1[N+](=O)[O-] 74941870 OBNSGOQARNATKT-UHFFFAOYSA-N 225.204 0.883 5 40 BCBB in-vitro Nc1ncnc(NCc2ccccn2)c1[N+](=O)[O-] 3912525 KXHBERFZEFNLHS-UHFFFAOYSA-N 246.230 0.974 5 40 BCBB O=[N+]([O-])c1ccn(CN2CCOCC2)n1 20028557 XQDQIMCUGQBULA-UHFFFAOYSA-N 212.209 0.081 5 40 BCBB CN1CCN(c2nn(C)cc2[N+](=O)[O-])CC1 309304423 MTYCIXMPPBDDKY-UHFFFAOYSA-N 225.252 0.080 5 40 BCBB Cc1[nH]c2cccc([N+](=O)[O-])c2c(=O)[n+]1C 4620572 DPWHCPPJEXJQKL-UHFFFAOYSA-O 220.208 0.569 5 40 BCBB Nc1c([N+](=O)[O-])cnn1CCN1CCCCC1 194404798 HQCCUNWXUQETDX-UHFFFAOYSA-N 239.279 0.859 5 40 BCBB O=C1C[C@H](c2ccccc2[N+](=O)[O-])NC(=O)N1 2643781 KHQMKTNFNBJWET-SSDOTTSWSA-N 235.199 0.865 5 40 BCBB C[N+]1([C@@H]2C[C@H]3CC[C@@H]2C3=O)CCOCC1 5029991 ZYOJMOBGJMTZFJ-OUAUKWLOSA-N 210.297 0.831 5 40 BCBB O=C1CNC(=O)N1Cc1ccc([N+](=O)[O-])cc1 15019148 RQUXUQHVECQMKF-UHFFFAOYSA-N 235.199 0.647 5 40 BCBB Cl/C=C\C[N+]12CN3CN(CN(C3)C1)C2 19327134 LDLCEGCJYSDJLX-UPHRSURJSA-N 215.708 0.248 5 40 BCBB O=C(O)c1ccnc(-n2ccc([N+](=O)[O-])n2)c1 40517165 XOZVAWSLXXJNSS-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB in-vitro O=C1COCC(=O)N1c1cccc([N+](=O)[O-])c1 59474465 HJEHNWNEKKGJIY-UHFFFAOYSA-N 236.183 0.485 5 40 BCBB CNC(=O)Nc1ccc(CC(=O)NO)cc1 220601412 IGFTVGZYNHCGAM-UHFFFAOYSA-N 223.232 0.486 5 40 BCBB CCn1ncc([N+](=O)[O-])c1-c1nnc(N)s1 408717823 WDJMVUQYIWPBCR-UHFFFAOYSA-N 240.248 0.912 5 40 BCBB Cn1nc([N+](=O)[O-])nc1Oc1cccnc1 4414596 GLVIXIGQSIICTH-UHFFFAOYSA-N 221.176 0.911 5 40 BCBB O=C(O)CNCc1cccc([N+](=O)[O-])c1 36722855 BBAOKRNCQSAKAA-UHFFFAOYSA-N 210.189 0.769 5 40 BCBB NC(=O)c1c(F)ccc([N+](=O)[O-])c1F 159398 GJMBOZSWKMBYGA-UHFFFAOYSA-N 202.116 0.972 5 40 BCBB CCOC(=O)CNC(=O)c1ccc([N+](=O)[O-])o1 2474051 MJNQJNGYXOPEDF-UHFFFAOYSA-N 242.187 0.481 5 40 BCBB CN1CCN(c2[nH]cnc2[N+](=O)[O-])CC1 6160457 YATRSXCIPKCFPO-UHFFFAOYSA-N 211.225 0.070 5 40 BCBB CCCc1nc2ncnn2c(O)c1[N+](=O)[O-] 9879948 ZTCALORJMNYFBS-UHFFFAOYSA-N 223.192 0.691 5 40 BCBB CN(C)S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1 2004364 ABMFUZRWANUQNU-UHFFFAOYSA-N 246.244 0.780 5 40 BCBB in-vitro COC(=O)CCNc1ccncc1[N+](=O)[O-] 37753314 LMLFNGJWVQXNOI-UHFFFAOYSA-N 225.204 0.965 5 40 BCBB in-vitro Nc1cc([N+](=O)[O-])c(C(=O)O)cc1C(=O)O 3845121 XXTHTNIIKPSJKI-UHFFFAOYSA-N 226.144 0.573 5 40 BCBB biogenic CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1C 30288776 UQEWYFUVGJOBRZ-UHFFFAOYSA-N 230.245 0.811 5 40 BCBB O=[N+]([O-])c1ccc(Nc2cnn(CCO)c2)nc1 48976750 YBNPJWLTNKIGRH-UHFFFAOYSA-N 249.230 0.922 5 40 BCBB CCN1C(=O)C[C@]2(C[N+]3(C)CCC2CC3)C1=O 346793 RADOKHLHYKKIGT-VROQLPPWSA-N 237.323 0.622 5 40 BCBB CC(C)COC(=O)C[C@H](O)C[N+](C)(C)C 2540756 ZMMYCSLZEBZFSM-JTQLQIEISA-N 218.317 0.643 5 40 BCBB in-vitro CCc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-] 16162149 MWDFYPDSWMARNT-UHFFFAOYSA-N 230.245 0.805 5 40 BCBB O=C(O)[C@@H]1CNC[C@H]1c1ccccc1[N+](=O)[O-] 4241630 UAPQUOMPLVHDJP-DTWKUNHWSA-N 236.227 0.982 5 40 BCBB CNc1nc(N)c([N+](=O)[O-])c(N2CCCC2)n1 5176462 GJNXJTTXWWNURX-UHFFFAOYSA-N 238.251 0.609 5 40 BCBB CN(C)C(=O)c1cc([N+](=O)[O-])ccc1CO 72209226 ARVIXQOFXKOFKE-UHFFFAOYSA-N 224.216 0.789 5 40 BCBB COCCn1cnc2ccc([N+](=O)[O-])cc2c1=O 12898044 GUPFRFLRCYCQTN-UHFFFAOYSA-N 249.226 0.951 5 40 BCBB CN(C)CCNC(=O)c1ccc([N+](=O)[O-])o1 16971008 GPPNYRTXACDFDQ-UHFFFAOYSA-N 227.220 0.479 5 40 BCBB CCN(CCO)c1nc(OC)ccc1[N+](=O)[O-] 80223845 YHZCNDJTFLKXCY-UHFFFAOYSA-N 241.247 0.817 5 40 BCBB O=C(Nc1nc[nH]n1)c1ccc([N+](=O)[O-])cc1 6883060 ZGALGAJAQYISLR-UHFFFAOYSA-N 233.187 0.965 5 40 BCBB COc1ccc([N+](=O)[O-])cc1-n1cnnn1 84021 UYNDQEVLKVMNPY-UHFFFAOYSA-N 221.176 0.579 5 40 BCBB C[C@@H]1Oc2ccc([N+](=O)[O-])nc2NC1=O 76750279 AMZNFBGOBSQKFR-BYPYZUCNSA-N 209.161 0.709 5 40 BCBB COc1ccc(C(=O)NCCO)cc1[N+](=O)[O-] 4702893 HTYABWILUHPSDP-UHFFFAOYSA-N 240.215 0.326 5 40 BCBB Cn1nc([N+](=O)[O-])c(Cl)c(Cl)c1=O 22151793 JGWYGJNFIGGGLI-UHFFFAOYSA-N 224.003 0.995 5 40 BCBB in-vitro COc1nc(OC)c([N+](=O)[O-])cc1C(=O)O 71254772 BCQSFUSFJMIGJM-UHFFFAOYSA-N 228.160 0.705 5 40 BCBB C[N+](C)(C)CCC(=O)CC[N+](C)(C)C 1622726 HWCRIVMIFSRZEM-UHFFFAOYSA-N 202.342 0.748 5 40 BCBB Cc1cnn(C(=O)c2nn(C)cc2[N+](=O)[O-])c1 2777770 OIJQABSUSFBPBP-UHFFFAOYSA-N 235.203 0.522 5 40 BCBB O=Cc1cn(-c2cccc([N+](=O)[O-])c2)nn1 84198691 WHAZRBLEEWXEQI-UHFFFAOYSA-N 218.172 0.988 5 40 BCBB O=C(NCCO)c1ccc([N+](=O)[O-])cc1Cl 32628472 YICVOSAYOTXRNP-UHFFFAOYSA-N 244.634 0.970 5 40 BCBB CCN1C(=O)C[C@@]2(C[N+]3(C)CCC2CC3)C1=O 346794 RADOKHLHYKKIGT-IQYSWEBNSA-N 237.323 0.622 5 40 BCBB CNc1ncc([N+](=O)[O-])cc1C(=O)OC 52507780 HTZBLXXWGQTRJC-UHFFFAOYSA-N 211.177 0.818 5 40 BCBB C[C@@H]1CN(c2ncccc2[N+](=O)[O-])CCN1 15443722 JRVIFHPFNSWJLO-MRVPVSSYSA-N 222.248 0.788 5 40 BCBB Cc1cc(C)n(C(=O)c2c([N+](=O)[O-])cnn2C)n1 33406 DKVYSIUXTBAXEZ-UHFFFAOYSA-N 249.230 0.830 5 40 BCBB CC(C)OC(=O)Cn1cnc([N+](=O)[O-])n1 4718979 REPAWNRPORWAHQ-UHFFFAOYSA-N 214.181 0.138 5 40 BCBB O=C1Nc2cc([N+](=O)[O-])ccc2O[C@H]1CCO 12336386 UUCMEEZSTSDRCR-VIFPVBQESA-N 238.199 0.677 5 40 BCBB O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccncc1 32726603 BWGQWWSBSPRXGN-UHFFFAOYSA-N 247.214 0.825 5 40 BCBB Cc1n[nH]c(=O)n1-c1cccc([N+](=O)[O-])c1 91293232 IKCAIMXHAJUZKD-UHFFFAOYSA-N 220.188 0.777 5 40 BCBB O=C(O)Cn1cc(Cl)c([N+](=O)[O-])n1 2487605 UFSKQIACMFKXSG-UHFFFAOYSA-N 205.557 0.529 5 40 BCBB N[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O 20789952 OXOPSXXYBQVJEG-QMMMGPOBSA-N 235.199 0.185 5 40 BCBB COC(=O)COC(=O)c1ccccc1[N+](=O)[O-] 86653 HCAKFFWZGXNSBE-UHFFFAOYSA-N 239.183 0.925 5 40 BCBB Cc1ccc(CNC(=O)[C@H]2C[C@H]2[N+](=O)[O-])n1C 32933166 CQJFPTGXTSJWNO-VHSXEESVSA-N 237.259 0.615 5 40 BCBB O=[N+]([O-])c1ccc(N2CC(O)C2)c(F)c1 57839018 RFLFVSJCVSQTKH-UHFFFAOYSA-N 212.180 0.915 5 40 BCBB Cc1cc(S(N)(=O)=O)cc([N+](=O)[O-])c1C 4218856 MXSQHPHMAHPHMF-UHFFFAOYSA-N 230.245 0.859 5 40 BCBB in-vitro CCOC(=O)c1n[nH]c2c([N+](=O)[O-])[nH]nc12 1103303 UUIJIMZBMVVLQN-UHFFFAOYSA-N 225.164 0.371 5 40 BCBB O=[N+]([O-])c1ccc(NCCOCCO)nc1 20324379 TVWBMIOQRFADKC-UHFFFAOYSA-N 227.220 0.411 5 40 BCBB Cn1cnnc1CNc1ncccc1[N+](=O)[O-] 26706393 NBOWDSQCZCGXNY-UHFFFAOYSA-N 234.219 0.730 5 40 BCBB N[C@H]1CCN(c2ncccc2[N+](=O)[O-])C1 50244242 OARZYUTUPOBYGU-ZETCQYMHSA-N 208.221 0.527 5 40 BCBB Cc1ccn(Cn2cc([N+](=O)[O-])cn2)n1 76494854 XZAIYKRCDIDDLR-UHFFFAOYSA-N 207.193 0.802 5 40 BCBB O=[N+]([O-])c1cc(O)c([N+](=O)[O-])cc1O 95482938 YTTGBZFJDLAQRS-UHFFFAOYSA-N 200.106 0.914 5 40 BCBB CCOC(=O)Nc1nc[nH]c1[N+](=O)[O-] 4115065 YDBBLKDJCIFNOG-UHFFFAOYSA-N 200.154 0.886 5 40 BCBB CNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 25199446 VRJJOGUHCSVYFR-UHFFFAOYSA-N 237.215 0.071 5 40 BCBB Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCCC1 72334114 YXYOCBLNXVICPB-UHFFFAOYSA-N 238.247 0.954 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])nn1C(F)F 71373568 WMSRVPUDGZFSQI-UHFFFAOYSA-N 207.092 0.885 5 40 BCBB Cc1cc([N+](=O)[O-])ccc1S(N)(=O)=O 91640 KVRWKUUAOATUGG-UHFFFAOYSA-N 216.218 0.551 5 40 BCBB in-vitro Cn1cc(Cn2ccc([N+](=O)[O-])n2)cn1 2538885 IOCJJLLDHAJJNR-UHFFFAOYSA-N 207.193 0.573 5 40 BCBB O=C(O)[C@@H]1COc2cc([N+](=O)[O-])ccc2O1 810225 JSFQNXNIULHEFN-QMMMGPOBSA-N 225.156 0.819 5 40 BCBB OCC[N+]12CCCC[C@@H]1[C@H](CO)CCC2 4082733 QVZWEBDEFQVARW-LAGVYOHYSA-N 214.329 0.750 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCC[C@H]1C(=O)O 4370069 MZWLPQOCYQOPMF-LURJTMIESA-N 240.219 0.382 5 40 BCBB Cc1ncc([N+](=O)[O-])n1CCSC(N)=O 13283656 BPFUDPJHWFTUSU-UHFFFAOYSA-N 230.249 0.912 5 40 BCBB CN(C)c1ccc([N+](=O)[O-])cc1C(N)=O 22124632 UVMJEURJSXMYRI-UHFFFAOYSA-N 209.205 0.760 5 40 BCBB Nc1nc(N)nc(-c2ccc([N+](=O)[O-])o2)n1 1653011 SUDMLGKFWIJSEI-UHFFFAOYSA-N 222.164 0.204 5 40 BCBB CN(C)C(=O)CN(C)c1ncccc1[N+](=O)[O-] 23623353 RXXMWIOYJPHQBB-UHFFFAOYSA-N 238.247 0.514 5 40 BCBB Cc1nn(C)c(NCC2(O)CCC2)c1[N+](=O)[O-] 78727593 JKEBJGZCKBCKEE-UHFFFAOYSA-N 240.263 0.964 5 40 BCBB O=[N+]([O-])C[C@]12O[C@H]3[C@H]4[C@H]5[C@@H]6C[C@H]([C@@H]5[C@H]41)[C@@H]2[C@@H]63 100246371 ONOSZFXFPMJTBZ-PEPLWKDOSA-N 219.240 0.788 5 40 BCBB O=c1ccc(O)nn1Cc1ccc([N+](=O)[O-])cc1 49615 VDWGNGWHZLHOFX-UHFFFAOYSA-N 247.210 0.905 5 40 BCBB O=c1[nH]cnc2c([N+](=O)[O-])c(F)ccc12 34502954 CJBKDJKOXRYRRV-UHFFFAOYSA-N 209.136 0.970 5 40 BCBB O=[N+]([O-])c1ccc(O)c(-n2cnnc2)c1 66111171 LRBQQMWLYWBUJR-UHFFFAOYSA-N 206.161 0.881 5 40 BCBB O=c1c2n[nH]c3nonc3nc-2c2ccccc12 100958923 HWWRHRFOKDFZGM-UHFFFAOYSA-N 239.194 0.959 5 40 BCBB C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)NC1=O 181423 NWBOWKFCGBXAIE-JTQLQIEISA-N 235.199 0.649 5 40 BCBB O=C1[C@H](n2cc([N+](=O)[O-])cn2)CCN1C1CC1 96496789 DKSJWTWYHHBPNR-SECBINFHSA-N 236.231 0.727 5 40 BCBB Cc1nn(C(C)(C)C(=O)O)cc1[N+](=O)[O-] 2535187 HXNPNONTJZMZHL-UHFFFAOYSA-N 213.193 0.919 5 40 BCBB O=c1c([N+](=O)[O-])c(N2CCC2)nc2ccccn12 24201490 ALUGREUURIRDPN-UHFFFAOYSA-N 246.226 0.813 5 40 BCBB O=C1Nc2cc(F)c([N+](=O)[O-])cc2C1=O 36379519 PUULBMGUQRBTGM-UHFFFAOYSA-N 210.120 0.869 5 40 BCBB in-vitro O=c1[nH]nnn1-c1ccc([N+](=O)[O-])cc1Cl 96180981 SPHXXXHCDDOHOW-UHFFFAOYSA-N 241.594 0.517 5 40 BCBB CC(C)Oc1nn(CCN)cc1[N+](=O)[O-] 408716814 RGSYYVIYZCNKJV-UHFFFAOYSA-N 214.225 0.537 5 40 BCBB Cn1ncc2c(-n3ccc([N+](=O)[O-])n3)ncnc21 50931356 UZXAFEHQJGVPRV-UHFFFAOYSA-N 245.202 0.457 5 40 BCBB O=C1Nc2ccc([N+](=O)[O-])cc2O[C@H]1CCO 4072886 XFMZSIGEYJLZHN-QMMMGPOBSA-N 238.199 0.677 5 40 BCBB NCCNc1ncnc2ccc([N+](=O)[O-])cc12 81588871 DHWRUXWBVKMXDC-UHFFFAOYSA-N 233.231 0.909 5 40 BCBB CN(C)C(=N)Nc1ncccc1[N+](=O)[O-] 225246387 KOOQCXCUWXQBFN-UHFFFAOYSA-N 209.209 0.898 5 40 BCBB CC(=O)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O 1684151 NOVSWSHOJUDPRJ-UHFFFAOYSA-N 234.167 0.737 5 40 BCBB O=[N+]([O-])C(CO)(CO)C1CCCCC1 6664447 SSRGVAXUAPSGEE-UHFFFAOYSA-N 203.238 0.567 5 40 BCBB CNC(=O)CN(C)c1ncccc1[N+](=O)[O-] 19309411 UCAJARWXHXFCJM-UHFFFAOYSA-N 224.220 0.172 5 40 BCBB O=C1COCCN1c1ccccc1[N+](=O)[O-] 34632977 OXVFGUUCIPAZSM-UHFFFAOYSA-N 222.200 0.958 5 40 BCBB in-vitro O=c1cc[n+]([O-])c(-c2cccc([N+](=O)[O-])c2)[nH]1 226825227 UVWUPAMZVSJYIJ-UHFFFAOYSA-N 233.183 0.584 5 40 BCBB N=C(N)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 4181912 PTOZRXKSOXZKIM-UHFFFAOYSA-N 210.149 0.787 5 40 BCBB CC(=O)CS(=O)(=O)c1ccccc1[N+](=O)[O-] 67172813 MIDXYAAQUGUUGW-UHFFFAOYSA-N 243.240 0.958 5 40 BCBB COc1cc([C@H](N)C(=O)O)cc([N+](=O)[O-])c1O 72196580 IMVTYNWRCKFQLQ-ZETCQYMHSA-N 242.187 0.393 5 40 BCBB CCCn1cc([N+](=O)[O-])cc(C(N)=O)c1=O 12737498 APQFTYLBJRMMOA-UHFFFAOYSA-N 225.204 0.265 5 40 BCBB Cc1nccc(-n2cc([N+](=O)[O-])cn2)n1 84483546 CTRMFIKDHUNFHJ-UHFFFAOYSA-N 205.177 0.879 5 40 BCBB Cn1cnc([N+](=O)[O-])c1N1CCOCC1 4302245 SDDGYSGBZFQKQF-UHFFFAOYSA-N 212.209 0.165 5 40 BCBB Cc1ccc([C@H](N)C(=O)O)cc1[N+](=O)[O-] 72196157 CADHYKIGVGHPAN-QMMMGPOBSA-N 210.189 0.988 5 40 BCBB C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)NC1=O 181422 NWBOWKFCGBXAIE-SNVBAGLBSA-N 235.199 0.649 5 40 BCBB C[C@@H](O)[C@H]([N+](=O)[O-])[C@@](C)(O)Br 3956696 MQHAOXSTVZHBGN-MROZADKFSA-N 228.042 0.116 5 40 BCBB NC(=O)c1ccc(CC(=O)O)c([N+](=O)[O-])c1 4831820 BTPWKCIJGGJRLD-UHFFFAOYSA-N 224.172 0.321 5 40 BCBB O=C1C[C@@H](c2ccccc2[N+](=O)[O-])NC(=O)N1 2643782 KHQMKTNFNBJWET-ZETCQYMHSA-N 235.199 0.865 5 40 BCBB COC(=O)c1nn(CCF)cc1[N+](=O)[O-] 408717240 XHGQOHLVPCVEPZ-UHFFFAOYSA-N 217.156 0.547 5 40 BCBB CNC[C@H](O)COc1ccc([N+](=O)[O-])cc1 19864672 VXKBHPFLIUMGNB-VIFPVBQESA-N 226.232 0.554 5 40 BCBB in-vitro Cc1cccc([N+](=O)[O-])c1S(N)(=O)=O 36666947 RBJVDTBCPCLEJF-UHFFFAOYSA-N 216.218 0.551 5 40 BCBB CCOc1nc(N)c([N+](=O)[O-])cc1[N+](=O)[O-] 98175221 TXSNDCNSXCDOJB-UHFFFAOYSA-N 228.164 0.879 5 40 BCBB O=[N+]([O-])C[C@@]12O[C@H]3[C@H]4[C@H]5[C@H]([C@H]6C[C@H]5[C@@H]3[C@@H]61)[C@H]42 100246353 ONOSZFXFPMJTBZ-KDNKLTIESA-N 219.240 0.788 5 40 BCBB N[C@@H](CC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O 2566916 KBJZPNMDKSNLIZ-QMMMGPOBSA-N 238.199 0.580 5 40 BCBB in-vitro COc1c(F)cc(C(N)=O)cc1[N+](=O)[O-] 57351194 UENVWBZBBHSQQL-UHFFFAOYSA-N 214.152 0.841 5 40 BCBB COC(=O)/C(C)=C/Cn1cnc([N+](=O)[O-])c1 84001826 PHWDYGCRPACYPE-XVNBXDOJSA-N 225.204 0.911 5 40 BCBB CC(C)(C)C(=O)Cn1cnc([N+](=O)[O-])n1 8295844 CFCOUVPPEUYDGR-UHFFFAOYSA-N 212.209 0.802 5 40 BCBB COc1nc(OC)c([N+](=O)[O-])cc1[N+](=O)[O-] 3953287 SDSANVDGVIOROB-UHFFFAOYSA-N 229.148 0.915 5 40 BCBB O=[N+]([O-])c1c(Cl)ncnc1N1CCNCC1 40448194 FYZWMGHHYNUZBA-UHFFFAOYSA-N 243.654 0.448 5 40 BCBB N[C@@H](CC(=O)O)c1cc(O)ccc1[N+](=O)[O-] 44196807 WSMXFDBLFDKLBJ-ZETCQYMHSA-N 226.188 0.775 5 40 BCBB Cn1nccc1CNc1[nH]ncc1[N+](=O)[O-] 6827647 BTSCJZRVPQBALL-UHFFFAOYSA-N 222.208 0.664 5 40 BCBB Cc1[nH]nc(NCC(=O)O)c1[N+](=O)[O-] 20045730 SFXBUUPMNUPZDG-UHFFFAOYSA-N 200.154 0.123 5 40 BCBB CCCC(CCC(N)=O)(CCC(N)=O)[N+](=O)[O-] 1857354 WVWBCPSRFABXQN-UHFFFAOYSA-N 245.279 0.333 5 40 BCBB Cc1ncc([N+](=O)[O-])n1CCOC(=O)N(C)C 130711035 PQFLHIPUSXXPPJ-UHFFFAOYSA-N 242.235 0.798 5 40 BCBB CC(=O)Nc1c(O)cc(C(=O)O)cc1[N+](=O)[O-] 3833968 JIDRTCHFBHJIDG-UHFFFAOYSA-N 240.171 0.957 5 40 BCBB in-vivo O=C(O)c1cc(=O)n(-c2ccc([N+](=O)[O-])cc2)[nH]1 38342316 IASSWUBTPXIYLD-UHFFFAOYSA-N 249.182 0.772 5 40 BCBB CS(=O)(=O)C[C@@H](O)c1cccc([N+](=O)[O-])c1 95095245 SPBKGSCWEBWNNZ-SECBINFHSA-N 245.256 0.673 5 40 BCBB O=C1CCN[C@H](c2ccc(O)c([N+](=O)[O-])c2)N1 408736688 FMUVXUOJUITMSX-JTQLQIEISA-N 237.215 0.409 5 40 BCBB Cc1c(Cl)c([N+](=O)[O-])nn1CC(N)=O 1084565 GBTBESVGVKLQJY-UHFFFAOYSA-N 218.600 0.238 5 40 BCBB O=C(O)CCCn1nc([N+](=O)[O-])cc1[N+](=O)[O-] 1548918921 RGZGJJMKFPTFRV-UHFFFAOYSA-N 244.163 0.564 5 40 BCBB CS(=O)(=O)c1cccc(N)c1[N+](=O)[O-] 126861144 JZSYWPDRBGMYLL-UHFFFAOYSA-N 216.218 0.581 5 40 BCBB CCNC(=O)c1ccc(N)c([N+](=O)[O-])c1 12735303 YQFIXDBXNMRXBI-UHFFFAOYSA-N 209.205 0.927 5 40 BCBB CN(CC(N)=O)Cc1c(F)cccc1[N+](=O)[O-] 69775177 JHCGBPVKTUCWII-UHFFFAOYSA-N 241.222 0.651 5 40 BCBB Cn1nc([N+](=O)[O-])cc1C(=O)N1CCCC1 72334117 MRFJMGRDLXMHRD-UHFFFAOYSA-N 224.220 0.564 5 40 BCBB O=C(c1ccc([N+](=O)[O-])cc1)n1cncn1 320480 LBLNFPMIIPYIHF-UHFFFAOYSA-N 218.172 0.875 5 40 BCBB O=C1NC(=O)/C(=C\c2ccccc2[N+](=O)[O-])N1 443296 WRPWONRKBCAFDU-FNORWQNLSA-N 233.183 0.775 5 40 BCBB CN(C)c1ncnc2[nH]cc([N+](=O)[O-])c12 1699648 YQFACFWPEKRHRY-UHFFFAOYSA-N 207.193 0.932 5 40 BCBB Cc1nc(SC[C@@H](O)CO)c([N+](=O)[O-])[nH]1 5690850 AWINWOPSZIVRLW-YFKPBYRVSA-N 233.249 0.072 5 40 BCBB CN1CCc2[nH]c(=O)c([N+](=O)[O-])cc2C1 96510600 XNXLNESVXBNHJF-UHFFFAOYSA-N 209.205 0.271 5 40 BCBB CCN(CC)C(=O)N1CC[N+](C)([O-])CC1 5845717 KAJAFGMERLXELG-UHFFFAOYSA-N 215.297 0.708 5 40 BCBB world CNC(=O)COc1ccc(OC)cc1[N+](=O)[O-] 7035435 QPBDZUBGXLEZEW-UHFFFAOYSA-N 240.215 0.728 5 40 BCBB NC(=O)c1cc2cccc([N+](=O)[O-])c2oc1=O 95471148 RRIYTMLDKGLTIC-UHFFFAOYSA-N 234.167 0.800 5 40 BCBB O=C1NC(=O)/C(=C/c2ccc(O)c([N+](=O)[O-])c2)N1 100253436 BDFAXSQHSAMCFA-UTCJRWHESA-N 249.182 0.481 5 40 BCBB C[C@H](O)[C@H]([N+](=O)[O-])[C@](C)(O)Br 100296217 MQHAOXSTVZHBGN-YUPRTTJUSA-N 228.042 0.116 5 40 BCBB O=C(O)c1cnnn1-c1cccc([N+](=O)[O-])c1 49826184 GLARFMMYMLNAEZ-UHFFFAOYSA-N 234.171 0.874 5 40 BCBB O=[N+]([O-])c1ccc(N2C=NC=NC[C@@H]2O)cc1 71405321 XSXJOLPYSKSTKQ-JTQLQIEISA-N 234.215 0.790 5 40 BCBB C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)O 2656421 RKVURLUZPDESNH-BYPYZUCNSA-N 228.160 0.391 5 40 BCBB O=[N+]([O-])c1cnn(CCC2OCCCO2)c1 71978647 VTVUUTRIYVAEND-UHFFFAOYSA-N 227.220 0.944 5 40 BCBB NC(=O)c1cc([N+](=O)[O-])c(N)c(F)c1F 90367261 WGCFNXVWHYDULR-UHFFFAOYSA-N 217.131 0.554 5 40 BCBB N#CNS(=O)(=O)c1ccccc1[N+](=O)[O-] 5679977 XUZAVMDPKDNLIA-UHFFFAOYSA-N 227.201 0.354 5 40 BCBB O=[N+]([O-])c1ccccc1OC[C@H](O)CO 59355114 VYYIKGCZHKHONW-SSDOTTSWSA-N 213.189 0.327 5 40 BCBB COC(=O)c1n[nH]c([N+](=O)[O-])c1[N+](=O)[O-] 5320264 IICJQYBGRNMGPF-UHFFFAOYSA-N 216.109 0.013 5 40 BCBB C=CS(=O)(=O)c1ccc([N+](=O)[O-])nc1 35322365 SPHBFESLIAWSIK-UHFFFAOYSA-N 214.202 0.907 5 40 BCBB Nc1ccc(OCC(=O)O)c([N+](=O)[O-])c1 687761266 LRIPMALFJYDNSR-UHFFFAOYSA-N 212.161 0.640 5 40 BCBB NC(=S)NNc1ccc([N+](=O)[O-])cc1 39209920 JJRWANIPJUWNPW-UHFFFAOYSA-N 212.234 0.755 5 40 BCBB CCCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 76556614 UQBWTKRPJOSJOH-UHFFFAOYSA-N 226.236 0.777 5 40 BCBB C[C@@H](C(=O)O)n1ccc(=O)c([N+](=O)[O-])c1 133127593 SRSLFOHXMOCWKD-YFKPBYRVSA-N 212.161 0.402 5 40 BCBB NC(=O)[C@@H]1CC(c2ccccc2[N+](=O)[O-])=NO1 97081699 WVMMSCPWQIKBAU-VIFPVBQESA-N 235.199 0.573 5 40 BCBB O=c1[nH]nc(O)n1-c1ccc([N+](=O)[O-])cc1 38435773 UTMXMYSMOXIBFN-UHFFFAOYSA-N 222.160 0.174 5 40 BCBB O=C(Nc1ccc([N+](=O)[O-])cc1)Nn1cnnc1 4373564 WXDUQXBMDFVQDS-UHFFFAOYSA-N 248.202 0.962 5 40 BCBB CCNC(=O)c1c([N+](=O)[O-])c(C)nn1C 76556607 NQDBVQODFPSYHR-UHFFFAOYSA-N 212.209 0.386 5 40 BCBB O=[N+]([O-])c1ccc(N2CCS(=O)CC2)nc1 69568790 AIQSEOYRDFESKR-UHFFFAOYSA-N 241.272 0.559 5 40 BCBB C[C@H]1C[N@@]1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 1857524262 IPKIIZQGCWXJFM-OIBJUYFYSA-N 242.256 0.988 5 40 BCBB CC(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1 2515938 HYBXLDUPXUPJQQ-SNVBAGLBSA-N 224.216 0.764 5 40 BCBB CCCCCCC(CO)(CO)[N+](=O)[O-] 3956701 LCYDLGLFXRGMCV-UHFFFAOYSA-N 205.254 0.957 5 40 BCBB Nc1ccc([C@@H]2CNC(=O)C2)c([N+](=O)[O-])c1 199777606 UTLNRDKSYVQNGY-LURJTMIESA-N 221.216 0.781 5 40 BCBB O=[N+]([O-])c1ccc([C@@H](O)S(=O)(=O)O)cc1 5945028 WRSIQYIEVOPSQZ-ZETCQYMHSA-N 233.201 0.474 5 40 BCBB CNS(=O)(=O)c1ccc(OC)cc1[N+](=O)[O-] 21817902 TXYFEPWOENHTRG-UHFFFAOYSA-N 246.244 0.512 5 40 BCBB O=[N+]([O-])c1cnn(CCSc2cn[nH]n2)c1 89764496 HKNQCHVVZGMRFZ-UHFFFAOYSA-N 240.248 0.702 5 40 BCBB O=[N+]([O-])c1ncccc1N1CCOCC1 95081265 PRISVRLXDAEDEN-UHFFFAOYSA-N 209.205 0.826 5 40 BCBB Cc1nc2cc([N+](=O)[O-])cc(NN)c2c(=O)n1C 6668693 RKXUWEDGYAYKQV-UHFFFAOYSA-N 249.230 0.436 5 40 BCBB COc1ccc(C(=O)CN)cc1[N+](=O)[O-] 36057457 KDEMSQKQVHAGFZ-UHFFFAOYSA-N 210.189 0.745 5 40 BCBB NC(=O)c1cnn(-c2cccc([N+](=O)[O-])c2)c1N 57469812 LJDCDQOFCZPMRJ-UHFFFAOYSA-N 247.214 0.462 5 40 BCBB CCn1cc([N+](=O)[O-])c(NCCOC)n1 95098508 HUDMDJMDJDTZRN-UHFFFAOYSA-N 214.225 0.870 5 40 BCBB C[N+](C)(C)[C@H]1C=CCC2=C1S(=O)(=O)C2 1721953 VMVVYZGDFPFXQB-VIFPVBQESA-N 214.310 0.704 5 40 BCBB CN(C)C[C@H](O)COc1ccc([N+](=O)[O-])cc1 4917620 PCCRZPIJPREQTI-JTQLQIEISA-N 240.259 0.896 5 40 BCBB O=c1[nH]c(O)nnc1Cc1ccccc1[N+](=O)[O-] 39281169 OUDYPBXPANHCMW-UHFFFAOYSA-N 248.198 0.370 5 40 BCBB CN(CC(N)=O)c1ncc(Cl)cc1[N+](=O)[O-] 95430272 XGYWGOHLBSERCY-UHFFFAOYSA-N 244.638 0.565 5 40 BCBB O=[N+]([O-])c1ccc(O)c(-n2cnnn2)c1 4902685 WTSJYDYLGYNHRZ-UHFFFAOYSA-N 207.149 0.276 5 40 BCBB in-vitro CN(C)CCCC(=O)OCC[N+](C)(C)C 1677401 FKXCENPCEJAPQL-UHFFFAOYSA-N 217.333 0.578 5 40 BCBB CCOC(=O)C[C@@H](C(=O)OCC)[C@H](C)[N+](=O)[O-] 32911434 GVCIHMUGJCWCKR-JGVFFNPUSA-N 247.247 0.784 5 40 BCBB C[C@@H]1CN1P1(=O)OCC(C)([N+](=O)[O-])CO1 4962201 HRHDTUXTJNZJNC-XHEJLGSBSA-N 236.164 0.881 5 40 BCBB Cc1cc([N+](=O)[O-])nn1CSCC(=O)O 12394751 VSQTZAJGBTWAEQ-UHFFFAOYSA-N 231.233 0.875 5 40 BCBB NC(=O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cn1 13014467 ZOIZIHPWRWZTPZ-QMMMGPOBSA-N 236.231 0.444 5 40 BCBB NCCNC(=O)c1ccc([N+](=O)[O-])cc1 13834267 KWWPRACPGGPLMF-UHFFFAOYSA-N 209.205 0.283 5 40 BCBB NC[C@H](O)COc1ccc([N+](=O)[O-])cc1 22174052 KPZYZMIPQWYOMC-QMMMGPOBSA-N 212.205 0.293 5 40 BCBB CON(C)C(=O)COc1ccc([N+](=O)[O-])cc1 32847860 ZINMTXHBLCZXAA-UHFFFAOYSA-N 240.215 0.993 5 40 BCBB COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N 4042469 BLVZXLIGARVLJC-UHFFFAOYSA-N 241.159 0.872 5 40 BCBB Nc1n[nH]c2c([N+](=O)[O-])cc([N+](=O)[O-])cc12 4416005 CHIKJKNEGGLWAU-UHFFFAOYSA-N 223.148 0.962 5 40 BCBB CC[C@@H](C)NC(=O)Cn1cnc([N+](=O)[O-])c1 823958 DAZXOKDGJLLSOZ-SSDOTTSWSA-N 226.236 0.706 5 40 BCBB C[N+](C)(C)CCN1C(=O)CSC1=O 3208525 WEEXPGUGFLYCEK-UHFFFAOYSA-N 203.287 0.388 5 40 BCBB CN(N)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] 4578907 YMBHFDADJOADTC-UHFFFAOYSA-N 212.165 0.813 5 40 BCBB CCOc1cc(-n2cc([N+](=O)[O-])cn2)ncn1 121252130 CMMMMLGLZPGVMZ-UHFFFAOYSA-N 235.203 0.969 5 40 BCBB CNc1ncc([N+](=O)[O-])c2c1ncn2C 20171144 CDUCORPHSGURIT-UHFFFAOYSA-N 207.193 0.918 5 40 BCBB Cn1cnc([N+](=O)[O-])c1NCCN1CC=CC1 101335304 KTBDYPZEIHGSCJ-UHFFFAOYSA-N 237.263 0.612 5 40 BCBB O=[N+]([O-])c1ccc(O[C@@H]2CCNC2)nc1 42783016 GQHRIECAOQIFLJ-MRVPVSSYSA-N 209.205 0.731 5 40 BCBB O=C(O)Cn1ncc([N+](=O)[O-])c1C(F)F 408715861 GACHOJZYNNBLDG-UHFFFAOYSA-N 221.119 0.814 5 40 BCBB CNC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 3353655 OJUCIBVEODOYKM-UHFFFAOYSA-N 212.209 0.154 5 40 BCBB CC(=O)Oc1nncc([N+](=O)[O-])c1OC(C)=O 217721697 LIMJFWPZCZLUHW-UHFFFAOYSA-N 241.159 0.235 5 40 BCBB Cc1cc([N+](=O)[O-])ccc1P(=O)(O)O 1870291 NKVDWVIMDKLENB-UHFFFAOYSA-N 217.117 0.706 5 40 BCBB CCOC(=O)[C@H](C)[C@@](C)(O)C[N+](=O)[O-] 5460067 JLKMVZMXSKOHLP-XPUUQOCRSA-N 205.210 0.213 5 40 BCBB O=[N+]([O-])c1ncn(Cc2nncs2)n1 95116218 RDBGMFASOUFGCN-UHFFFAOYSA-N 212.194 0.086 5 40 BCBB COC(=O)CN(C)c1ccc([N+](=O)[O-])cn1 48322232 NGTZKMFCSLZAGK-UHFFFAOYSA-N 225.204 0.599 5 40 BCBB O=C(O)c1cc([N+](=O)[O-])cc2n[nH]nc12 1309547 JLCPTYPYZSGOJQ-UHFFFAOYSA-N 208.133 0.564 5 40 BCBB O=c1ccc(O)nn1-c1ccc([N+](=O)[O-])cc1 4353788 NQIUSEAELVWABE-UHFFFAOYSA-N 233.183 0.846 5 40 BCBB CNC(=O)c1ccc(NN)c([N+](=O)[O-])c1 51095648 OLBJURUFURFRLD-UHFFFAOYSA-N 210.193 0.240 5 40 BCBB O=[N+]([O-])c1ccc2ncnc(NCCO)c2c1 81589079 GGGHSSDXJBIBPH-UHFFFAOYSA-N 234.215 0.942 5 40 BCBB Cn1cc([N+](=O)[O-])c(C(=O)Nc2ncccn2)n1 2807258 UVMQVEYUDZLTJL-UHFFFAOYSA-N 248.202 0.371 5 40 BCBB CN(C)C(=O)c1ccc([N+](=O)[O-])cc1N 59686717 WVEZBIDTQJHTFX-UHFFFAOYSA-N 209.205 0.879 5 40 BCBB CN(C)[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1 2561228 WKFXOUSFZMOKOH-QWRGUYRKSA-N 240.259 0.551 5 40 BCBB Nc1ccc([C@H]2CNC(=O)C2)c([N+](=O)[O-])c1 199777588 UTLNRDKSYVQNGY-ZCFIWIBFSA-N 221.216 0.781 5 40 BCBB O=[N+]([O-])c1ccc(N2CC[C@@H](O)C2)nc1 61707393 USIKCAKKNZHNLC-MRVPVSSYSA-N 209.205 0.561 5 40 BCBB COC(=O)CNc1ccncc1[N+](=O)[O-] 20370301 DWPKZJXOWZMHQJ-UHFFFAOYSA-N 211.177 0.575 5 40 BCBB in-vitro Cn1cnnc1CNc1ccc([N+](=O)[O-])cn1 26706524 MFUGHUWRPYBUGP-UHFFFAOYSA-N 234.219 0.730 5 40 BCBB O=[N+]([O-])c1ccc(NC(CO)CO)c(F)c1 72295197 ZLEUCBSYAPQYGT-UHFFFAOYSA-N 230.195 0.499 5 40 BCBB Cc1cc(N2CC[C@@H](O)C2)ncc1[N+](=O)[O-] 80600980 SAZKZCSUBAEKBT-MRVPVSSYSA-N 223.232 0.869 5 40 BCBB NS(=O)(=O)c1ccc([N+](=O)[O-])s1 4566104 IDJMUFYNVVEAIS-UHFFFAOYSA-N 208.220 0.304 5 40 BCBB in-vitro O=c1cc(O)c2c(ccc3[nH]c(=O)cc(O)c32)[nH]1 5531088 QZVDLXNWNIQAMH-UHFFFAOYSA-N 244.206 0.781 5 40 BCBB O=[N+]([O-])c1ccc(CNCCNCCO)cc1 16401579 CHHUMUPVXGCLKM-UHFFFAOYSA-N 239.275 0.266 5 40 BCBB O=[N+]([O-])c1cccnc1N1CCC[C@H](O)C1 23709406 FSZUZUBPJAFQOU-QMMMGPOBSA-N 223.232 0.951 5 40 BCBB COc1ccc([N+](=O)[O-])cc1NCC(N)=O 80540913 NCBRUMDJVXMGMP-UHFFFAOYSA-N 225.204 0.501 5 40 BCBB Cc1c(C(=O)Nn2cnnc2)cccc1[N+](=O)[O-] 321549 HZUROKFTASCERO-UHFFFAOYSA-N 247.214 0.879 5 40 BCBB C[N+](C)(C)[C@@H]1C=CCC2=C1S(=O)(=O)C2 4973138 VMVVYZGDFPFXQB-SECBINFHSA-N 214.310 0.704 5 40 BCBB C[C@@H](O)CNc1ccc([N+](=O)[O-])c(N)c1 5276045 ZVSXXPZMBODAOZ-ZCFIWIBFSA-N 211.221 0.970 5 40 BCBB CCOC(=O)c1cc(N)c([N+](=O)[O-])cn1 67172320 PGSAVGAWCWMKJF-UHFFFAOYSA-N 211.177 0.749 5 40 BCBB Cc1nc(N2CCNCC2)c([N+](=O)[O-])[nH]1 9060417 XSNZSKAAABDXFA-UHFFFAOYSA-N 211.225 0.036 5 40 BCBB CNS(=O)(=O)c1ccc(C)cc1[N+](=O)[O-] 101570412 XFXHGVMFPFZYRL-UHFFFAOYSA-N 230.245 0.811 5 40 BCBB CC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] 16742756 RSERZKYBFDBMOI-UHFFFAOYSA-N 238.199 0.757 5 40 BCBB O=C(NCc1nccs1)[C@@H]1C[C@H]1[N+](=O)[O-] 65474648 KJAOTAPNEOTDFY-PHDIDXHHSA-N 227.245 0.425 5 40 BCBB Cc1c(N)c(=O)n(-c2ccc([N+](=O)[O-])cc2)n1C 36947751 IZAKJUDEOSXMJI-UHFFFAOYSA-N 248.242 0.975 5 40 BCBB CNC(=S)n1c([N+](=O)[O-])cnc1C 16363358 KQYDDCDESLOXAA-UHFFFAOYSA-N 200.223 0.452 5 40 BCBB COc1cc([N+](=O)[O-])ccc1NCCN 45958628 HFRGQIHVLYGZBS-UHFFFAOYSA-N 211.221 0.974 5 40 BCBB O=C(O)c1cccc(P(=O)(O)O)c1[N+](=O)[O-] 1870299 BZVIJENWCVSYBO-UHFFFAOYSA-N 247.099 0.096 5 40 BCBB CCOC(=O)CCn1ccc([N+](=O)[O-])n1 12396516 JRVVWQNTUVWIOU-UHFFFAOYSA-N 213.193 0.745 5 40 BCBB CONC(=O)c1ccc(OC)c([N+](=O)[O-])c1 13001186 YHNJAPLOXPDWNZ-UHFFFAOYSA-N 226.188 0.895 5 40 BCBB O=C1NCCOc2ccc([N+](=O)[O-])cc21 34936176 QKXGFMXLKHZJOV-UHFFFAOYSA-N 208.173 0.717 5 40 BCBB O=C(O)CNc1ccc([N+](=O)[O-])cc1C(=O)O 4830628 CVZBWXPNOYERSL-UHFFFAOYSA-N 240.171 0.790 5 40 BCBB O=c1[nH]cc(N2CCCC2)cc1[N+](=O)[O-] 95836334 CPUKZTWKYPKLKE-UHFFFAOYSA-N 209.205 0.883 5 40 BCBB CNS(=O)(=O)c1ccc(F)c([N+](=O)[O-])c1 7374491 PRTLSVYSOPRSIX-UHFFFAOYSA-N 234.208 0.642 5 40 BCBB COc1cccc([C@H](N)C(=O)O)c1[N+](=O)[O-] 72196352 COYXMYINEKGECW-ZETCQYMHSA-N 226.188 0.688 5 40 BCBB Cc1c([N+](=O)[O-])c(C(=O)N(C)C)nn1C 72242870 OIQVDVXHSHIPAC-UHFFFAOYSA-N 212.209 0.339 5 40 BCBB CNc1cc(OC[C@H](O)CO)ccc1[N+](=O)[O-] 34751538 CDRHDQOGKXFJSA-SSDOTTSWSA-N 242.231 0.369 5 40 BCBB NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 35286500 CUSHOTAZJAKYSX-UHFFFAOYSA-N 230.245 0.327 5 40 BCBB in-vitro O=C(O)CNCc1ccccc1[N+](=O)[O-] 36883051 PRJCIUDMDQNJCJ-UHFFFAOYSA-N 210.189 0.769 5 40 BCBB Cc1cc(O)n2nc(N)c([N+](=O)[O-])c2n1 139536643 HNNJJPQDQSPYNP-UHFFFAOYSA-N 209.165 0.234 5 40 BCBB CCNC(=O)Cn1nc(C)c([N+](=O)[O-])c1C 2630985 OTKRYMSQYVFSGC-UHFFFAOYSA-N 226.236 0.544 5 40 BCBB