smiles	zinc_id	inchikey	mwt	logp	reactive	purchasable	tranche_name	features
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN([C@@H]2CCOC2=O)CC1	36386898	IQCGAWRYOZPZID-CYBMUJFWSA-N	369.399	0.525	5	40	FCBB	
COC(=O)c1nc(N)nc(C(=O)OC)c1C(=O)c1ccc([N+](=O)[O-])cc1	1588091	FTBOGQBQGDUTOF-UHFFFAOYSA-N	360.282	0.771	5	40	FCBB	
Nc1nc(NCCO)nc(N2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-]	54147612	DRETWXSCWBXYTC-UHFFFAOYSA-N	373.417	0.693	5	40	FCBB	
Cc1c(C(=O)OCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	6200719	IMLKQMVPJPZECL-LLVKDONJSA-N	370.383	0.706	5	40	FCBB	
COc1cc2nc3ccc(C(=O)NCCCO)cn3c(=O)c2cc1OC	12898991	NXKHKQAPGIOHLD-UHFFFAOYSA-N	357.366	0.977	5	40	FCBB	biogenic
O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(C[C@H]3CCOCO3)CC2)c1	95956605	QCIIDCNGXOJCMH-CQSZACIVSA-N	371.415	0.664	5	40	FCBB	
O=C1CN(c2ncccc2NC(=O)CCn2cc([N+](=O)[O-])cn2)CCN1	95389941	XWSRQRYPBGMUNN-UHFFFAOYSA-N	359.346	0.151	5	40	FCBB	
CC(=O)N1C(=O)N(C[C@@H](O)COc2ccc([N+](=O)[O-])cc2)C(=O)C1(C)C	3081949	LMYSKZYCESOZQA-GFCCVEGCSA-N	365.342	0.924	5	40	FCBB	
O=C1CN(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(=O)N1	25613112	UBEVYBMWZUUDRO-UHFFFAOYSA-N	350.334	0.738	5	40	FCBB	
CC(=O)NCCn1ncc2c(=O)n(Cc3cccc([N+](=O)[O-])c3)cnc21	12071802	TVWHTXHZZMUNTP-UHFFFAOYSA-N	356.342	0.686	5	40	FCBB	
Cc1ccc(C(=O)NCC(=O)NCc2nnc3ccccn23)cc1[N+](=O)[O-]	8944424	NDAWPRIPAXBNKW-UHFFFAOYSA-N	368.353	0.992	5	40	FCBB	
Cc1sc(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)cc1[N+](=O)[O-]	25210385	RDWDUUAZSJMLFX-UHFFFAOYSA-N	362.433	0.529	5	40	FCBB	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(-n2cncn2)nc1	40070192	NDSVDZCHVYXYPT-UHFFFAOYSA-N	367.325	0.939	5	40	FCBB	
CCN(CC)C(=O)[C@@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])c(N)n1	95469004	MXYZULIIKKSZAI-NSHDSACASA-N	353.404	0.956	5	40	FCBB	
COc1ccc(NC(=O)C[C@H]2SC[C@H](C(=O)O)NC2=O)c([N+](=O)[O-])c1	15910128	BEJHFWGJGMABNV-MWLCHTKSSA-N	369.355	0.617	5	40	FCBB	
COC(CN1CC2=C(C1=O)[C@@H](c1ccc([N+](=O)[O-])cc1)NC(=O)N2)OC	8755450	YKLPBHGJHUPTFX-CQSZACIVSA-N	362.342	0.664	5	40	FCBB	
O=C1C[C@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CN1	95941915	RYPQOSYQNAAGFC-ZETCQYMHSA-N	364.177	0.524	5	40	FCBB	
O=[N+]([O-])c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCNCC1	3886886	OWLLIFOZCPRFGA-UHFFFAOYSA-N	356.404	0.025	5	40	FCBB	
COC(=O)C1CCN(C(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)CC1	2647333	YLGNEZZJRLGORV-UHFFFAOYSA-N	374.353	0.716	5	40	FCBB	
CN(C(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)[C@@H]1CN2CCC1CC2	609532467	CUVJLILVLFRWSH-OAHLLOKOSA-N	374.397	0.873	5	40	FCBB	
O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3)cc2[nH]c1=O	13582124	HSVUJJSTPKTWAY-UHFFFAOYSA-N	362.323	0.925	5	40	FCBB	
COc1cc(/C=C2/NC(=O)N(CC(=O)O)C2=O)c([N+](=O)[O-])cc1OC	408591657	IYTMORPKFWQMKY-FPYGCLRLSA-N	351.271	0.589	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@@H]2[C@@H](C1=O)[C@@]1(CO)C=C[C@@]2(C)O1	408975015	IPXHQMYZAOJLPK-CLROSIBMSA-N	360.322	0.799	5	40	FCBB	
O=C(CN1C(=O)CCC1=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2	24661277	PIYXDBRONLPONC-UHFFFAOYSA-N	350.283	0.654	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1SC[C@H](C(=O)O)NC1=O	3322348	GRJRUBAQGHMNCR-KOLCDFICSA-N	369.355	0.617	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N1C(=O)C[C@@H](N2CCC(C(N)=O)CC2)C1=O	18029934	XRWBTFYEFBCDMS-CQSZACIVSA-N	360.370	0.732	5	40	FCBB	
O=[N+]([O-])c1cnn(C[C@@H](O)CN2CCN(c3nc4ccccc4[nH]3)CC2)c1	95454662	WYFQSWWQMZSIDA-AWEZNQCLSA-N	371.401	0.851	5	40	FCBB	
Cc1c(C2=NO[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@@H]23)cnn1C	103507715	KMIAUIQYGONVBM-JSGCOSHPSA-N	355.310	0.929	5	40	FCBB	
COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(CO)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1	408733442	JIEZJPKCXDEIFS-GFOFROLCSA-N	360.322	0.799	5	40	FCBB	
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@@H]1c1ccccc1[N+](=O)[O-]	12417464	QVNCBRMSRLGETO-GFCCVEGCSA-N	374.305	0.908	5	40	FCBB	biogenic,in-vitro
Cn1ccnc1[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccccc1F	40152597	NIHFSONTLJBZGW-ZDUSSCGKSA-N	359.321	0.965	5	40	FCBB	
O=C(O)/C=C/C(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	3887744	AVPUHKCDENOLPD-SNAWJCMRSA-N	369.355	0.069	5	40	FCBB	
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(S(=O)(=O)N(C)C)CC1	25207293	SNZJDJHESJQXPL-UHFFFAOYSA-N	371.419	0.201	5	40	FCBB	
Cn1c(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc(=O)n(C)c1=O	11228247	KXAOKBDTBTVHDM-UHFFFAOYSA-N	374.353	0.924	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN([C@H]2CCOC2=O)CC1	37187810	IQCGAWRYOZPZID-ZDUSSCGKSA-N	369.399	0.525	5	40	FCBB	
O=C(NC[C@H](O)c1ccccc1)c1nc(Cn2ccc([N+](=O)[O-])n2)no1	12375981	YUJFTGBBHLUXPM-NSHDSACASA-N	358.314	0.686	5	40	FCBB	
O=C(NCc1nnc2n1CCC2)c1cc([N+](=O)[O-])ccc1N1CCOCC1	24444298	NOSCAGOXNYNMBR-UHFFFAOYSA-N	372.385	0.899	5	40	FCBB	
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(NS(C)(=O)=O)CC1	11103882	IWZONWCRRGIXDR-NSHDSACASA-N	370.431	0.935	5	40	FCBB	
O=C(NCCN1CCS(=O)(=O)CC1)c1ccc([N+](=O)[O-])cc1Cl	58161483	VJXPCDXLSUMFCA-UHFFFAOYSA-N	361.807	0.708	5	40	FCBB	
COc1ccc(S(=O)(=O)N2CCSC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	95461751	BTNKMVLCBNDYIF-SNVBAGLBSA-N	361.401	0.195	5	40	FCBB	
COCCNC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	4889804	XKLAQKBZFCKQPV-UHFFFAOYSA-N	367.358	0.351	5	40	FCBB	
CCN1CCN(c2nc(N3C[C@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])CC1	5031044	YPRITOSBRGJKRZ-RYUDHWBXSA-N	365.438	0.723	5	40	FCBB	
C[C@H](CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)N1CCN(C)CC1	95428058	DWCDXEQMHVFFBC-CQSZACIVSA-N	370.475	0.693	5	40	FCBB	
COC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC)C(=O)C[C@@]1(C)O	4099770	WGETYYLVMDBIRH-SZOQZIPDSA-N	365.338	0.981	5	40	FCBB	
COCCN(CCOC)C(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1	5659788	KXZOGSHSHJCCCN-UHFFFAOYSA-N	355.347	0.455	5	40	FCBB	
Cn1c(=O)c2c(Cl)c([N+](=O)[O-])c(=O)n(-c3ccccc3)c2n(C)c1=O	2564996	BYQILSRTYMEYSQ-UHFFFAOYSA-N	362.729	0.950	5	40	FCBB	
O=C1[C@@H]2[C@H]3C=C[C@@](C4OCCO4)(O3)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1	409294975	NIJKFIBEQYEGOZ-KOFHJDLBSA-N	358.306	0.781	5	40	FCBB	
C[C@H]1CN=C(N2CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC2)S1	96007123	MJQGUJKFVQBCMZ-VIFPVBQESA-N	350.404	0.821	5	40	FCBB	
O=C(NCCN1CCOCC1)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	20646729	DKXIWFMLRNCYHR-CQSZACIVSA-N	363.418	0.655	5	40	FCBB	
CS(=O)(=O)NC1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	10044379	IRPQUYHCPLYDAP-UHFFFAOYSA-N	363.417	0.297	5	40	FCBB	
CN(C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCS(=O)(=O)C1	12942894	NYCCEPDBPVFIMA-ZDUSSCGKSA-N	369.399	0.360	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H](NCCOCCO)C(=O)O	4939716	FFQIUAGSDFLHBM-CYBMUJFWSA-N	355.347	0.284	5	40	FCBB	
CCOCCCNC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	409133004	PYTYXLNZFJSADV-UHFFFAOYSA-N	359.404	0.904	5	40	FCBB	
Cc1nc(N)[nH]c(=O)c1CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	8622414	XRNSEGPZNXHLFE-UHFFFAOYSA-N	367.387	0.480	5	40	FCBB	
Cc1cc(NC(=O)Cn2cnc([N+](=O)[O-])c2)n([C@@H]2CCS(=O)(=O)C2)n1	31804837	IYKPCDLGTKPTRV-SNVBAGLBSA-N	368.375	0.295	5	40	FCBB	
CCOC(=O)COCCN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	95964788	XMRVVBYPYMYSJV-MRXNPFEDSA-N	365.342	0.942	5	40	FCBB	
Cc1ccc(NC(=O)C[C@@H]2SC(NC(=N)N)=NC2=O)cc1[N+](=O)[O-]	20407187	BVXBGMLNCRSVJJ-VIFPVBQESA-N	350.360	0.713	5	40	FCBB	
CCOC(=O)[C@@H]1[C@@H](c2ccc([N+](=O)[O-])o2)NC(=O)N[C@]1(O)C(F)(F)F	5447455	UCHURUZOEPEFNH-VAOFZXAKSA-N	367.236	0.972	5	40	FCBB	
O=C(NCCN1CCOCC1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	26182361	MRYCTGDZEGTYHD-UHFFFAOYSA-N	363.418	0.759	5	40	FCBB	
CCOC(=O)c1cc(C(=O)NCC2(O)CCN(C)CC2)cc([N+](=O)[O-])c1	72306591	MDNLLGCIQZODHL-UHFFFAOYSA-N	365.386	0.958	5	40	FCBB	
CN1CCN2c3ccc([N+](=O)[O-])cc3C[C@]3(C(=O)N(C)C(=O)N=C3O)[C@@H]2C1	16956882	ZBYMYDKOQQZGAL-GUYCJALGSA-N	373.369	0.806	5	40	FCBB	
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1	2805220	RMYZXERTCMAOJO-GXFFZTMASA-N	365.302	0.061	5	40	FCBB	biogenic,in-vitro
O=C(CNC(=O)COc1ccccc1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	8770205	OUAFEFRGWGTSAZ-MRXNPFEDSA-N	373.365	0.940	5	40	FCBB	
CCOC(=O)[C@@H]1Cc2c([nH]c(=O)[nH]c2=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1	1575187	FQCZDYNWLAHGCW-ZYHUDNBSSA-N	361.310	0.827	5	40	FCBB	
CS(=O)(=O)N[C@@H]1CCCN(Cn2ncc3cc([N+](=O)[O-])ccc32)C1	41620445	BWZSRBDWGCYPLJ-GFCCVEGCSA-N	353.404	0.916	5	40	FCBB	
O=[N+]([O-])c1ccc(S(=O)(=O)N(C2CC2)[C@@H]2CCS(=O)(=O)C2)cc1	45811092	LSUXQARQWCXYJB-GFCCVEGCSA-N	360.413	0.935	5	40	FCBB	
CCN1CCN(c2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)O[C@@H](C)C3)n2)CC1	5217006	NBWYJFRXOSUWEP-RYUDHWBXSA-N	365.438	0.723	5	40	FCBB	
CCNC(=O)CNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	95349240	PXVUGIBGOIDDRP-SECBINFHSA-N	352.322	0.339	5	40	FCBB	
C[C@H](O)[C@@H](CCN[C@@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	217339345	SYUWUHQRKQWNLI-NJZAAPMLSA-N	370.427	0.941	5	40	FCBB	
CN1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@@H]32)C1=O	8974946	PQQHISLDHXICJA-WBMJQRKESA-N	360.326	0.051	5	40	FCBB	
Nc1nc(N2CCN(Cc3ccccc3)CC2)nc(NCCO)c1[N+](=O)[O-]	20479341	IXPUCMXOWGMIDJ-UHFFFAOYSA-N	373.417	0.693	5	40	FCBB	
COCCNC(=O)COC(=O)CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	6097730	HGJAVLIMILZWPF-UHFFFAOYSA-N	373.749	0.284	5	40	FCBB	
O=c1n(CCNc2cc([N+](=O)[O-])ccc2NCCO)nc2ccccn12	36829778	PJLQAPJGDIZNRM-UHFFFAOYSA-N	358.358	0.921	5	40	FCBB	
O=C(c1n[nH]cc1[N+](=O)[O-])N1CCN(S(=O)(=O)c2cccs2)CC1	17076070	UXBBZTALRBWKBI-UHFFFAOYSA-N	371.400	0.526	5	40	FCBB	
COc1ccc(S(=O)(=O)N2C[C@H](C(N)=O)CC[C@H]2C)c([N+](=O)[O-])c1	40135554	YPVPMMJHXDMEND-NXEZZACHSA-N	357.388	0.878	5	40	FCBB	
O=C(O)CN1C[C@]2([N+](=O)[O-])CC=C(Br)[C@@]([N+](=O)[O-])(C1)C2	100083615	LJZUOANBIHOMFH-UWVGGRQHSA-N	350.125	0.490	5	40	FCBB	
CCOC(=O)N[C@H]1CS(=O)(=O)C[C@@H]1NCc1ccc([N+](=O)[O-])cc1	575419930	AVFFKKNPZFKQKI-STQMWFEESA-N	357.388	0.596	5	40	FCBB	
O=C(N[C@@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	20648456	HBODRRYPWDHOND-VXGBXAGGSA-N	368.415	0.510	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H](C(=O)O)N1CCN(C)CC1	22997044	OIFFSUNNAVKSFQ-AWEZNQCLSA-N	350.375	0.932	5	40	FCBB	
C[C@@H](O)[C@@H](CCN[C@@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	217339267	SYUWUHQRKQWNLI-UXIGCNINSA-N	370.427	0.941	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](C(=O)O)N1CCN(C)CC1	22997047	OIFFSUNNAVKSFQ-CQSZACIVSA-N	350.375	0.932	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCNC[C@H]2c2ccccc2)n1	599099683	JGIDTQWEFLLWDV-LBPRGKRZSA-N	351.388	0.664	5	40	FCBB	
O=C1N=c2ccc([N+](=O)[O-])cc2=C1NN1CCN(Cc2ccccc2)CC1	6864172	OYGMDWOHIXABFT-UHFFFAOYSA-N	365.393	0.185	5	40	FCBB	
O=C(NC1CC1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	12782883	ZVLVMAOMDOVHQQ-UHFFFAOYSA-N	354.388	0.773	5	40	FCBB	
O=[N+]([O-])c1ccccc1S(=O)(=O)N(C1CC1)[C@@H]1CCS(=O)(=O)C1	58457580	NCSLOOMBLGLHIU-LLVKDONJSA-N	360.413	0.935	5	40	FCBB	
NC(=O)CN1C(=O)[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	4555103	UKBHYADKXVQYDO-GOSISDBHSA-N	369.333	0.887	5	40	FCBB	
O=c1[nH]c(=O)c2ncn(S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)c2[nH]1	19593729	GMKUESQHNOWFLR-UHFFFAOYSA-N	371.718	0.212	5	40	FCBB	
CC1CCN(c2nc(NCCN3CCOCC3)nc(N)c2[N+](=O)[O-])CC1	20292176	UOSOEJJGSQJIRU-UHFFFAOYSA-N	365.438	0.947	5	40	FCBB	
CCNC(=O)c1cc2c(=O)n3cc(C)ccc3nc2n(CCOC)c1=N	100627896	IUWPEDPMOGCNDX-UHFFFAOYSA-N	355.398	0.833	5	40	FCBB	
NC(=O)c1ccc(NC[C@@H]([C@@H]2CCOC2)N2CCOCC2)c([N+](=O)[O-])c1	24203980	YVYJQZQWHONVGJ-CJNGLKHVSA-N	364.402	0.843	5	40	FCBB	
NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)N2CCc3sccc3C2)c1=O	25060674	KPODAQBMNWIJKT-UHFFFAOYSA-N	362.367	0.502	5	40	FCBB	
O=C1NCCN1[C@H]1CCCN(c2nc3ccccn3c(=O)c2[N+](=O)[O-])C1	48311501	YDKNDCPITWXIFG-NSHDSACASA-N	358.358	0.597	5	40	FCBB	
NS(=O)(=O)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)s1	35301049	XUFWIRGBJORRRF-UHFFFAOYSA-N	357.369	0.939	5	40	FCBB	
Cc1cc([N+](=O)[O-])c(S(=O)(=O)NCc2cc(C(N)=O)no2)cc1C	84077107	SHDLNVYENVSZJR-UHFFFAOYSA-N	354.344	0.777	5	40	FCBB	
C/C=C1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CC[N+]3([O-])CC[C@@H](OC1=O)[C@@H]23	4098666	IDIMIWQPUHURPV-WTWIWYCDSA-N	367.398	0.178	5	40	FCBB	in-vitro
Cc1ccc(S(=O)(=O)NCCCN2CCN(C)CC2)cc1[N+](=O)[O-]	22913972	UBDKGCRPRWIOJB-UHFFFAOYSA-N	356.448	0.819	5	40	FCBB	
C[C@@H](Cn1cccn1)NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	24806788	TUJTVZMIMBESET-NSHDSACASA-N	359.342	0.722	5	40	FCBB	
C[C@@H]1CN(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	12561493	KAKIVGBSZDHING-VXGBXAGGSA-N	358.420	0.950	5	40	FCBB	
O=C(C1=NN[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]12)c1ccco1	16037363	QGVJPTLXCFUXFY-YPMHNXCESA-N	354.278	0.888	5	40	FCBB	
O=C(NCCN1CCOCC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	14795850	SRBFGVLEMWARKJ-UHFFFAOYSA-N	364.402	0.493	5	40	FCBB	
Cc1c(F)cc(C(=O)NCCN2CCS(=O)(=O)CC2)cc1[N+](=O)[O-]	69774048	MBSYQJBUNUJJTN-UHFFFAOYSA-N	359.379	0.503	5	40	FCBB	
COC(=O)CN1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1	15406639	AQNXUDOBSANUMR-UHFFFAOYSA-N	357.388	0.383	5	40	FCBB	
COC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1	13597254	WGETYYLVMDBIRH-FHIRATQRSA-N	365.338	0.981	5	40	FCBB	
CCOC(=O)Cc1csc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)n1	31671817	VWSKDLQBLHZDBM-UHFFFAOYSA-N	366.355	0.957	5	40	FCBB	
O=C(O)CNC(=O)CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21	6624453	GWQLTOQOANDXGE-UHFFFAOYSA-N	367.361	0.472	5	40	FCBB	biogenic
CCOC(=O)COc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	9245684	VNHOMAOCDUSOFJ-UHFFFAOYSA-N	374.371	0.558	5	40	FCBB	
O=C(O)CNc1c([N+](=O)[O-])cc2c3c(cccc13)C(=O)N(CC(=O)O)C2=O	95471035	INHPPRQIIJRRHW-UHFFFAOYSA-N	373.277	0.925	5	40	FCBB	
Cc1cc(OS(=O)(=O)c2cn(C)c(=O)n(C)c2=O)ccc1[N+](=O)[O-]	12140181	YXWMZZCHLIIYEA-UHFFFAOYSA-N	355.328	0.068	5	40	FCBB	
NC(=O)[C@H]1CC[C@@H](CNC(=O)CCCNc2ccccc2[N+](=O)[O-])O1	84506978	VPZZTGPJNDAQLQ-SMDDNHRTSA-N	350.375	0.936	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1c(-c2ncccn2)noc1=O	58136475	KKPIBYZUMMMPCF-UHFFFAOYSA-N	372.297	0.849	5	40	FCBB	
N=C(N)NCCC[C@@H](NC(=O)OCc1ccc([N+](=O)[O-])cc1)C(=O)O	2560763	AMKFUKMKVGMLAK-LLVKDONJSA-N	353.335	0.537	5	40	FCBB	
Nc1cccc(S(=O)(=O)N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	5616295	XJFZMYQMBQILKK-GJZGRUSLSA-N	367.383	0.550	5	40	FCBB	
CCN(C(=O)[C@H](C)Oc1cccnc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	7202954	RGJLDSGXJVOSLH-QWRGUYRKSA-N	357.388	0.793	5	40	FCBB	
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC(=O)Nc1ccc2c(c1)OCCO2	9670779	XZNZGWMOOYQYHE-UHFFFAOYSA-N	374.309	0.876	5	40	FCBB	
COc1ccc(NC(=O)NC[C@H](O)CN2CCOCC2)c([N+](=O)[O-])c1	32796847	SUEGCEXQBNGGOZ-NSHDSACASA-N	354.363	0.418	5	40	FCBB	
O=C1NCCN1[C@@H]1CCCN(c2nc3ccccn3c(=O)c2[N+](=O)[O-])C1	48311503	YDKNDCPITWXIFG-LLVKDONJSA-N	358.358	0.597	5	40	FCBB	
CNS(=O)(=O)CCC(=O)O[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	95452631	NDBYGBRQUSQENR-LBPRGKRZSA-N	371.371	0.183	5	40	FCBB	
CS(=O)(=O)c1ccc(N2CCC3(CC2)NC(=O)NC3=O)c([N+](=O)[O-])c1	12595054	ZKGWWOFZWQQMFR-UHFFFAOYSA-N	368.371	0.177	5	40	FCBB	
O=C(N[C@@H]1CCS(=O)(=O)C1)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	20647855	OZTGTSNRVCSOKC-GFCCVEGCSA-N	368.415	0.510	5	40	FCBB	
O=C(/C=c1/[nH]c(=O)/c(=C\c2ccc(O)c([N+](=O)[O-])c2)s1)c1ccncc1	104548462	INNLYDIHSWRUBM-MICXRRPDSA-N	369.358	0.937	5	40	FCBB	
COC(=O)CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])c(OC)cc2OC)C1=O	408548844	LZRJFAGMWVQMGN-RUDMXATFSA-N	365.298	0.678	5	40	FCBB	
NC(=O)CCN(Cc1ccccc1)C(=O)Cn1cc([N+](=O)[O-])ccc1=O	9685973	PCCHXAAXLVTTBL-UHFFFAOYSA-N	358.354	0.661	5	40	FCBB	
C[C@@H]1CN(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	12610323	OKBNYZFIVWMKRO-VXGBXAGGSA-N	358.420	0.950	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1SC[C@@H](C(=O)O)NC1=O	3322354	GRJRUBAQGHMNCR-GXSJLCMTSA-N	369.355	0.617	5	40	FCBB	
COCC(=O)NC1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	4910193	XYBWOESOSGUPGZ-UHFFFAOYSA-N	357.388	0.511	5	40	FCBB	
Cn1cnc([N+](=O)[O-])c1N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	8318084	CYRXCIKFOXVPCN-UHFFFAOYSA-N	369.378	0.978	5	40	FCBB	
COC(=O)C1CCN(C(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)CC1	4412078	WXBAIOMFLYDLTD-UHFFFAOYSA-N	374.353	0.716	5	40	FCBB	
Cc1cc(NC(=O)CN2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)no1	32904475	CTTLDKQVRITCFP-UHFFFAOYSA-N	363.330	0.881	5	40	FCBB	
NC(=O)c1cc2c(c([N+](=O)[O-])c1)-c1c(cc(C(N)=O)cc1[N+](=O)[O-])C2=O	4574474	SEBZOHHXJWZGJS-UHFFFAOYSA-N	356.250	0.912	5	40	FCBB	
CNC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)NC)[C@@H]1c1cccc([N+](=O)[O-])c1	169429260	FLDMLTBKDNCSFC-WBOJAVRRSA-N	363.370	0.127	5	40	FCBB	
Cc1ccc(S(=O)(=O)NCCNC(=O)CN2CCCC2)cc1[N+](=O)[O-]	5342768	NQHDXIKBVPFKRW-UHFFFAOYSA-N	370.431	0.394	5	40	FCBB	
O=C(NC[C@@H](O)c1ccccc1)c1nc(Cn2cc([N+](=O)[O-])cn2)no1	12375978	MJZPFWQQTAANNN-GFCCVEGCSA-N	358.314	0.686	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	83882441	STNDHCUULBGWPM-WDEREUQCSA-N	356.404	0.959	5	40	FCBB	
CC(=O)OCCn1c(=O)c2ccc3c(=O)[nH]c(=O)c4ccc(c1=O)c2c34	227116786	YBORHNYJAKZECH-UHFFFAOYSA-N	352.302	0.155	5	40	FCBB	
CC(=O)OC[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12	409303415	GYDGAVYOTXLVPT-VWPFQQQWSA-N	358.306	0.971	5	40	FCBB	
COC(=O)c1c([N+](=O)[O-])ncn1[C@H]1C[C@@H](OC(C)=O)[C@@H](COC(C)=O)O1	4963336	NWWXMPJWFOFGCK-GMTAPVOTSA-N	371.302	0.360	5	40	FCBB	
O=[N+]([O-])c1c(N2CCN(C[C@@H](O)[C@@H]3CCCO3)CC2)nc2sccn12	79076689	PAHOSDWXBDWBAH-NEPJUHHUSA-N	367.431	0.966	5	40	FCBB	
NC(=O)CC[C@H](NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)O	8883794	TVEKPBCJOOOGMV-QMMMGPOBSA-N	365.751	0.245	5	40	FCBB	
O=C(N[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	13570535	HBODRRYPWDHOND-NEPJUHHUSA-N	368.415	0.510	5	40	FCBB	
CN(C)n1ccc2nc3ccn(CCN4CCOCC4)c(=O)c3cc2c1=O	40398683	AKIZMYLXNISVSC-UHFFFAOYSA-N	369.425	0.241	5	40	FCBB	
CS(=O)(=O)N1CCCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	24776795	MXQUVTCHZXQGJX-UHFFFAOYSA-N	357.388	0.468	5	40	FCBB	
CNC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@@H](C(=O)NC)[C@H]1c1cccc([N+](=O)[O-])c1	36619671	FLDMLTBKDNCSFC-ZOMKSWQUSA-N	363.370	0.127	5	40	FCBB	
N=c1c(C(N)=S)cc2c(=O)n3ccccc3nc2n1C[C@@H]1CCCO1	100894053	FVNPMFWRDBRBBR-JTQLQIEISA-N	355.423	0.942	5	40	FCBB	
COCCCNC(=O)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	24974532	VUISLSKGTYDDHX-UHFFFAOYSA-N	360.392	0.197	5	40	FCBB	
O=C(CN1C(=O)CNC1=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	9125733	ORYFJIBPPJWMCG-UHFFFAOYSA-N	361.270	0.240	5	40	FCBB	
Cc1ccc2nc3c(cc(C(N)=O)c(=N)n3Cc3cccnc3)c(=O)n2c1	100309698	VRAILYRQFIRKMZ-UHFFFAOYSA-N	360.377	0.979	5	40	FCBB	
NS(=O)(=O)c1ccc(NNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	16428662	SWIGGCSIGYGBPF-UHFFFAOYSA-N	372.384	0.548	5	40	FCBB	
CC1(C)NC(=O)N(CC(=O)OCC(=O)Nc2cccc([N+](=O)[O-])c2)C1=O	9126547	YHTFRJVVUYVCQH-UHFFFAOYSA-N	364.314	0.407	5	40	FCBB	
CCN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@H]32)C1=O	9423222	FDRQYFWLVXZCSM-SUMWQHHRSA-N	374.353	0.441	5	40	FCBB	
N=c1c(C(=O)NC2CCCC2)cc2c(=O)n3ccccc3nc2n1CCO	100861120	SZUQEWWEMNJPIF-UHFFFAOYSA-N	367.409	0.793	5	40	FCBB	
C[C@H](O)C(=O)N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)C(=O)O	2060999845	CISRMXYNELRALT-YGOYTEALSA-N	354.315	0.019	5	40	FCBB	
COC(=O)C1=NN(C(C)=O)[C@@]2(CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	9075548	JTLPYGQPVBMDGX-MRXNPFEDSA-N	374.309	0.378	5	40	FCBB	
O=C(COC(=O)Cn1cnnn1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	22677892	VXBQAOYOFFIUEA-UHFFFAOYSA-N	374.235	0.782	5	40	FCBB	
O=C1[C@H]2[C@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@@]1(C3OCCO3)C=C[C@H]2O1	409294967	NIJKFIBEQYEGOZ-HPTBWKMGSA-N	358.306	0.781	5	40	FCBB	
CNS(=O)(=O)c1ccc(N2CCN(C(=O)C3CC3)CC2)c([N+](=O)[O-])c1	12526704	WMNIFZUHADMMDL-UHFFFAOYSA-N	368.415	0.562	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(CO)C=C[C@@]2(C)O1	408975017	IPXHQMYZAOJLPK-GFOFROLCSA-N	360.322	0.799	5	40	FCBB	
CCN1CCN(c2nc(NC[C@@H]3CCCO3)nc(N)c2[N+](=O)[O-])CC1	4305985	ULPMRUSKRYRAGZ-NSHDSACASA-N	351.411	0.700	5	40	FCBB	
O=[N+]([O-])c1ccccc1S(=O)(=O)N(C1CC1)[C@H]1CCS(=O)(=O)C1	58457581	NCSLOOMBLGLHIU-NSHDSACASA-N	360.413	0.935	5	40	FCBB	
C[C@H](O)C(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)C(=O)O	2060999844	CISRMXYNELRALT-SBMIAAHKSA-N	354.315	0.019	5	40	FCBB	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](O)CN1CCOCC1	83967288	MIRSDCWPXGTXAX-TZMCWYRMSA-N	369.443	0.885	5	40	FCBB	
COC(=O)c1sc([N+](=O)[O-])cc1OCCCn1ccc(=O)[nH]c1=O	19872684	ZMHDPTVVNIXWSU-UHFFFAOYSA-N	355.328	0.762	5	40	FCBB	
CCNC(=O)CN1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	48312357	CHMNBKNJSOABSU-UHFFFAOYSA-N	370.431	0.178	5	40	FCBB	
CCNC(=O)NC(=O)COC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	3370147	MYYKWWBLFWAUPY-UHFFFAOYSA-N	355.303	0.615	5	40	FCBB	
CCOC(=O)C1=NN[C@@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]12	4898506	RKHGLKNDPDRRCI-ZJUUUORDSA-N	366.717	0.629	5	40	FCBB	
CC(=O)N1CN2CN(C(C)=O)CC([C@@H](O)c3ccc([N+](=O)[O-])cc3)(C2)C1	19905331	DDSXHWCIJTWGHC-INIZCTEOSA-N	362.386	0.556	5	40	FCBB	
COC(=O)c1nn(CCNC(=O)OC(C)(C)C)c(C(=O)OC)c1[N+](=O)[O-]	91696044	BWRVRDNYKSNYSW-UHFFFAOYSA-N	372.334	0.889	5	40	FCBB	
NC(=O)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	33010883	NRCMBVYSHMAGTI-ZDUSSCGKSA-N	368.415	0.833	5	40	FCBB	
C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(NS(C)(=O)=O)CC1	11104465	VFEJBYRWFUOORC-NSHDSACASA-N	370.431	0.935	5	40	FCBB	
COC(=O)[C@H](O)CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	96011334	CWGAWNMDQZFNCV-SECBINFHSA-N	372.277	0.834	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](NCCOCCO)C(=O)O	4939715	FFQIUAGSDFLHBM-ZDUSSCGKSA-N	355.347	0.284	5	40	FCBB	
O=C(O)CN1C[C@]2([N+](=O)[O-])CC=C(Br)[C@]([N+](=O)[O-])(C1)C2	2750149	LJZUOANBIHOMFH-VHSXEESVSA-N	350.125	0.490	5	40	FCBB	
CCN1CCN(c2nc(N3C[C@H](C)O[C@H](C)C3)nc(N)c2[N+](=O)[O-])CC1	5031029	YPRITOSBRGJKRZ-TXEJJXNPSA-N	365.438	0.723	5	40	FCBB	
C[C@]1(NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])CCS(=O)(=O)C1	24461458	VSIFVFUXYZUZAM-HNNXBMFYSA-N	370.383	0.374	5	40	FCBB	
Cc1nn(C)cc1S(=O)(=O)NCCCn1cc(Cl)c([N+](=O)[O-])n1	36614938	KFOSZJLNKJFTPF-UHFFFAOYSA-N	362.799	0.855	5	40	FCBB	
COC(=O)c1cc2c(=O)n3ccccc3nc2n(CCOC(C)=O)c1=N	16741229	CPOOHIIRQJVLJA-UHFFFAOYSA-N	356.338	0.478	5	40	FCBB	
O=C(N[C@H]1CCS(=O)(=O)C1)[C@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	13570536	HBODRRYPWDHOND-RYUDHWBXSA-N	368.415	0.510	5	40	FCBB	
COc1ccc(N2C(=O)[C@@H]3[C@@H](C2=O)[C@@]2(CO)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1	408733441	JIEZJPKCXDEIFS-CLROSIBMSA-N	360.322	0.799	5	40	FCBB	
O=C(Cn1cc([N+](=O)[O-])cn1)N1CCN(Cc2ccc3c(c2)OCO3)CC1	19874310	JHZPYWXUZZTYQD-UHFFFAOYSA-N	373.369	0.864	5	40	FCBB	
COCCNC(=O)CN(c1cc([N+](=O)[O-])ccc1OC)S(C)(=O)=O	9425878	SQJCMVFRITXSIA-UHFFFAOYSA-N	361.376	0.132	5	40	FCBB	
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	72408189	KGZFOKXZZZPAMQ-UHFFFAOYSA-N	350.374	0.019	5	40	FCBB	
COC[C@@H](C)NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O	10323933	SLXPFFWFSPTHNX-LLVKDONJSA-N	359.404	0.820	5	40	FCBB	
Cc1cccn2c(=O)c3cc(C(=O)NC[C@@H]4CCCO4)c(=N)n(C)c3nc12	100926772	KUQRLLCOLKZRNU-LBPRGKRZSA-N	367.409	0.883	5	40	FCBB	
CS(=O)(=O)Nc1cccc(CNC(=O)Cn2cc([N+](=O)[O-])cn2)c1	25240296	SFIZJVBHXCWTKF-UHFFFAOYSA-N	353.360	0.479	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N1C(=O)C[C@H](N2CCC(C(N)=O)CC2)C1=O	101982780	XRWBTFYEFBCDMS-AWEZNQCLSA-N	360.370	0.732	5	40	FCBB	
COC(=O)CC[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)OC	3061423	UEVGXLPCMMQAMK-NSHDSACASA-N	360.344	0.368	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@H]2CC(=O)N(C(C)C)C2)c([N+](=O)[O-])c1	60362911	VQTVQCGMAFRTDE-JTQLQIEISA-N	356.404	0.924	5	40	FCBB	
CC(C)NC(=O)CN(C)C(=O)CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	12915766	GZCYXFRKDICHIB-RMKNXTFCSA-N	362.386	0.707	5	40	FCBB	
COC(=O)C[C@@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C(=O)OC	72277414	VNRCQKVYZLPECR-SNVBAGLBSA-N	356.335	0.019	5	40	FCBB	
COCCNC(=O)C1CCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	9355752	XJTOXXHICAQONP-UHFFFAOYSA-N	371.415	0.758	5	40	FCBB	
CNC(=O)[C@H]1CN(C(=O)CCn2cnc([N+](=O)[O-])c2)c2ccccc2O1	25349988	DCDQZAISWCMFOZ-CYBMUJFWSA-N	359.342	0.722	5	40	FCBB	
CN(C)S(=O)(=O)N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	24694518	NGWXDDCZBBCTRO-UHFFFAOYSA-N	357.392	0.551	5	40	FCBB	
COc1cccc(CN(C)C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)c1	27053883	DTZVJBJLQFFJFJ-UHFFFAOYSA-N	374.353	0.523	5	40	FCBB	
CC(=O)O[C@@H]1[C@H](O)CO[C@H](Oc2ccccc2[N+](=O)[O-])[C@@H]1OC(C)=O	35645639	OPXWOTRGXPBRCG-NMFUWQPSSA-N	355.299	0.554	5	40	FCBB	
CN1CCC(NC(=O)CN(c2cccc([N+](=O)[O-])c2)S(C)(=O)=O)CC1	216937349	GEVOTJVDNWEWQA-UHFFFAOYSA-N	370.431	0.571	5	40	FCBB	
O=C1OCC[C@@H]1N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	36386890	QCCAUWAYJXUEKU-ZDUSSCGKSA-N	355.372	0.217	5	40	FCBB	
COc1cc(C(=O)O[C@@H](C(=O)NC(N)=O)C(C)C)c([N+](=O)[O-])cc1OC	3441652	BDNYVAILFSCFOI-GFCCVEGCSA-N	369.330	0.988	5	40	FCBB	
CCN(C(=O)COc1ccc(C)nc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	5970266	XSHOGWIRROZTOC-LLVKDONJSA-N	357.388	0.713	5	40	FCBB	
C[C@@H](C(=O)NC(N)=O)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1	57358638	MVFSAMCPTNEENC-NSHDSACASA-N	372.385	0.848	5	40	FCBB	
Cc1cc([N+](=O)[O-])cc(C)c1S(=O)(=O)N1CCN(CCO)C(=O)C1	95433379	VMVSDRROHNPMHN-UHFFFAOYSA-N	357.388	0.037	5	40	FCBB	
Nc1nc(NCCN2CCOCC2)nc(N2CCCCC2)c1[N+](=O)[O-]	20326184	MFFKJGVRSPQWRI-UHFFFAOYSA-N	351.411	0.701	5	40	FCBB	
CCOC(=O)COCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	95964789	XMRVVBYPYMYSJV-INIZCTEOSA-N	365.342	0.942	5	40	FCBB	
CC(=O)Oc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@H]2C=C[C@@]3(CO)O2)cc1[N+](=O)[O-]	409059711	XFWQJMJWZUTCDS-OEUWWYETSA-N	374.305	0.325	5	40	FCBB	
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(NS(C)(=O)=O)CC1	8855930	YREQYIHPGSPJGD-LLVKDONJSA-N	370.431	0.935	5	40	FCBB	
CC(C)CN(CC(C)C)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	40050064	GJVRKBSYJSEJPP-UHFFFAOYSA-N	352.391	0.996	5	40	FCBB	
O=C(OCC(=O)N1CCNC1=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	21421038	PBSJWNUGBKOADG-UHFFFAOYSA-N	351.271	0.075	5	40	FCBB	
O=C(COC(=O)CN1C(=O)CCC1=O)Nc1ccc([N+](=O)[O-])cc1Cl	24792221	SHCVUVQLRTWZLN-UHFFFAOYSA-N	369.717	0.879	5	40	FCBB	
O=C(NCCc1nnc2n1CCC2)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	69564405	NORZYHSNMLEURO-UHFFFAOYSA-N	368.357	0.686	5	40	FCBB	
NS(=O)(=O)c1ccc(NS(=O)(=O)c2ccc(O)c([N+](=O)[O-])c2)cc1	36748154	SKPUVNXZIODTRI-UHFFFAOYSA-N	373.368	0.749	5	40	FCBB	
CCOc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCNC2=O)cc1OC	9449483	QHDSVOUITDSUSD-UHFFFAOYSA-N	367.314	0.711	5	40	FCBB	
O=c1oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c2ccccc12	4064228	WNWBIUMUTUWNJA-OGJJZOIMSA-N	374.345	0.125	5	40	FCBB	biogenic
COc1nn(CCC(=O)N2N=CC[C@@]2(O)C(F)(F)F)cc1[N+](=O)[O-]	6641080	JPSJHZVDJMQWPB-SNVBAGLBSA-N	351.241	0.659	5	40	FCBB	
O=[N+]([O-])c1ccc(CCn2cnc3c(N(CCO)CCO)ncnc32)cc1	1609793	YVJKZVVEUUULMI-UHFFFAOYSA-N	372.385	0.768	5	40	FCBB	
CC1=C(C(N)=O)[C@@H](c2ccccc2[N+](=O)[O-])N2NC(CCCO)=NC2=N1	1795267	QQWLEAMMMVCYAR-CQSZACIVSA-N	358.358	0.756	5	40	FCBB	
Cc1nn(CS(=O)(=O)CC(=O)NC[C@@H]2CCCO2)c(C)c1[N+](=O)[O-]	8782658	DCGIPJKPHMNDRI-NSHDSACASA-N	360.392	0.076	5	40	FCBB	
Nc1nc(NCCN2CCOCC2)nc(NC[C@H]2CCCO2)c1[N+](=O)[O-]	20267265	ABCXQOUJDZQKLN-LLVKDONJSA-N	367.410	0.302	5	40	FCBB	
CN1CCN(C(=O)CS(=O)(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	23242855	GDNRZLQMUFFMMO-UHFFFAOYSA-N	372.359	0.051	5	40	FCBB	
O=C(O)CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)C1=O	408586696	AZFAVTPAKOIETO-FARCUNLSSA-N	352.215	0.186	5	40	FCBB	
O=C1CCCN1c1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	3956852	SYURIOLSRRXZQN-UHFFFAOYSA-N	355.372	0.743	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1O[C@@H](C)C(=O)N[C@@H]1CCS(=O)(=O)C1	7827715	SWFGWHPBUGHJQI-VHSXEESVSA-N	358.372	0.674	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@H]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	83882445	STNDHCUULBGWPM-MNOVXSKESA-N	356.404	0.959	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]12	101001299	CQOUUWHVVWVIEL-GXSJLCMTSA-N	361.270	0.369	5	40	FCBB	
O=C(NCCCN1CCOCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	23105388	QXGMZVUBGWRHGL-UHFFFAOYSA-N	354.338	0.511	5	40	FCBB	
O=[N+]([O-])c1cnn(C[C@H](O)CN2CCN(c3nc4ccccc4[nH]3)CC2)c1	95454663	WYFQSWWQMZSIDA-CQSZACIVSA-N	371.401	0.851	5	40	FCBB	
COc1ccc(S(=O)(=O)N(C)Cc2nnc3n2CCC3)c([N+](=O)[O-])c1	40039965	NZIFNGPMRBERRA-UHFFFAOYSA-N	367.387	0.962	5	40	FCBB	
O=C(CCn1cnc([N+](=O)[O-])n1)Nn1c(S)nc2ccccc2c1=O	102002703	NAZWGTCXWNTHPL-UHFFFAOYSA-N	361.343	0.345	5	40	FCBB	
C[C@@H](O)[C@H](CCN[C@@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	217339430	SYUWUHQRKQWNLI-KYOSRNDESA-N	370.427	0.941	5	40	FCBB	
CN(C(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)[C@H]1CN2CCC1CC2	609532464	CUVJLILVLFRWSH-HNNXBMFYSA-N	374.397	0.873	5	40	FCBB	
CS(=O)(=O)c1ccc(C(=O)OCC(=O)N2CCCC2)cc1[N+](=O)[O-]	3293907	OIFKLZPDQAKUDD-UHFFFAOYSA-N	356.356	0.778	5	40	FCBB	
O=C(CCn1cnc([N+](=O)[O-])n1)N1N=C(C(F)F)C[C@]1(O)C(F)F	6830015	DESNIJCSKKQBAH-JTQLQIEISA-N	354.220	0.384	5	40	FCBB	
COC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	32770726	DYTBJERKGZQHDH-SECBINFHSA-N	357.344	0.020	5	40	FCBB	
O=[N+]([O-])c1ccccc1N1CCN(C[C@H](O)CN2CCOCC2)CC1	26712225	BTUUGZUAIWFJEO-HNNXBMFYSA-N	350.419	0.410	5	40	FCBB	
CC(=O)N1CN2CN(C(C)=O)CC([C@H](O)c3ccc([N+](=O)[O-])cc3)(C2)C1	19905333	DDSXHWCIJTWGHC-MRXNPFEDSA-N	362.386	0.556	5	40	FCBB	
Cc1nn(CCCn2c(=O)c3c(ncn3C)n(C)c2=O)c(C)c1[N+](=O)[O-]	9731260	NBQJINFDLVWKLZ-UHFFFAOYSA-N	361.362	0.246	5	40	FCBB	
CS(=O)(=O)c1ccc(NCCNC(=O)COCC2CC2)c([N+](=O)[O-])c1	48301832	SJVYDWMFUYMIIE-UHFFFAOYSA-N	371.415	0.953	5	40	FCBB	
CN(C)CCNS(=O)(=O)c1ccc(N2CCSCC2)c([N+](=O)[O-])c1	52360983	WALJKGJVOYVZTR-UHFFFAOYSA-N	374.488	0.988	5	40	FCBB	
CC(=O)OC[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12	409303419	GYDGAVYOTXLVPT-XJIUQZFPSA-N	358.306	0.971	5	40	FCBB	
Cn1c(CNC(=O)c2cccc([N+](=O)[O-])c2)nnc1SCC(N)=O	409126002	ANCNFRIMTPTJOP-UHFFFAOYSA-N	350.360	0.231	5	40	FCBB	
Nn1ccc2nc3ccn(CCCN4CCOCC4)c(=O)c3cc2c1=O	40398639	WBGHZVFMDOIMSS-UHFFFAOYSA-N	355.398	0.148	5	40	FCBB	
COC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1	101509239	WGETYYLVMDBIRH-VWPFQQQWSA-N	365.338	0.981	5	40	FCBB	
Cc1c(NC(=O)Cn2cnc([N+](=O)[O-])n2)c(=O)n(-c2ccccc2)n1C	9008511	QHIFGTLTQNZTIO-UHFFFAOYSA-N	357.330	0.623	5	40	FCBB	
COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)NCCN1CCOCC1	19203930	BTKAAINHCRWVSD-UHFFFAOYSA-N	352.391	0.731	5	40	FCBB	
CS(=O)(=O)N[C@H]1CCCN(Cn2ncc3cc([N+](=O)[O-])ccc32)C1	41620447	BWZSRBDWGCYPLJ-LBPRGKRZSA-N	353.404	0.916	5	40	FCBB	
Cc1ccc(S(=O)(=O)NCCNC(=O)N2CCOCC2)cc1[N+](=O)[O-]	12631720	HTTNQYFVYJRIFR-UHFFFAOYSA-N	372.403	0.223	5	40	FCBB	
C[C@H]1CN(c2nc(N)c([N+](=O)[O-])c(N3CCN(C)CC3)n2)C[C@H](C)O1	5111909	VSVLOVLJQPPIQS-QWRGUYRKSA-N	351.411	0.332	5	40	FCBB	
O=C(NCCCN1CCCC1=O)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	10326838	IWEHRROMOTVUQB-UHFFFAOYSA-N	352.322	0.801	5	40	FCBB	
Nc1cccc(S(=O)(=O)N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	5616292	XJFZMYQMBQILKK-LSDHHAIUSA-N	367.383	0.550	5	40	FCBB	
CN(C)CCn1ccc2nc3ccn(-c4ccn[nH]4)c(=O)c3cc2c1=O	40399056	GNPLVUBRAMQIDY-UHFFFAOYSA-N	350.382	0.985	5	40	FCBB	
COC(=O)[C@H]1C(=O)C[C@](C)(O)[C@H](C(=O)OC)[C@@H]1c1ccc([N+](=O)[O-])cc1	13598232	WGWCVBPRRCTFRR-FHIRATQRSA-N	365.338	0.981	5	40	FCBB	
O=C(COC(=O)CN1C(=O)CCC1=O)Nc1ccc(Cl)cc1[N+](=O)[O-]	24274946	WSTPFZZPGLSWLD-UHFFFAOYSA-N	369.717	0.879	5	40	FCBB	
NC(=O)c1ccsc1NC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	16207869	UTZBTUVQSKJZDO-UHFFFAOYSA-N	374.334	0.990	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CC(=O)NC[C@H]2c2ccccc2)n1	1561953861	DZUWRLUQJYVLDI-NSHDSACASA-N	365.371	0.190	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCN(CCC(=O)O)CC1	6053390	LHNANRYJBSKTNS-UHFFFAOYSA-N	357.388	0.684	5	40	FCBB	
CCS(=O)(=O)N1CCN(CC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	36611243	PRXZWXCGCGDUOR-UHFFFAOYSA-N	356.404	0.501	5	40	FCBB	
COc1cc(C(=O)O[C@H](C(=O)NC(N)=O)C(C)C)c([N+](=O)[O-])cc1OC	3441651	BDNYVAILFSCFOI-LBPRGKRZSA-N	369.330	0.988	5	40	FCBB	
O=c1c2cc3c(=O)n(-n4cnnc4)ccc3nc2ccn1-c1ccccn1	38829257	JCDHOSNNDZBSDQ-UHFFFAOYSA-N	357.333	0.999	5	40	FCBB	
CC(=O)NCCNc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-]	8052757	BAWDFYKVDPHOTG-UHFFFAOYSA-N	356.404	0.927	5	40	FCBB	
CNC(=O)NC(=O)COC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	6548147	RBBTYZOAKOCKEV-UHFFFAOYSA-N	350.331	0.807	5	40	FCBB	
CN(Cc1ccsc1)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	12769171	YJZFEFFYWHNAIM-UHFFFAOYSA-N	350.356	0.576	5	40	FCBB	
CNC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)NC)C(=O)C[C@@]1(C)O	36619669	FLDMLTBKDNCSFC-SZOQZIPDSA-N	363.370	0.127	5	40	FCBB	
O=[N+]([O-])c1c(N2CCN(C[C@H](O)[C@@H]3CCCO3)CC2)nc2sccn12	79076687	PAHOSDWXBDWBAH-RYUDHWBXSA-N	367.431	0.966	5	40	FCBB	
O=C(NCCN1CCOCC1)[C@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	20646733	DKXIWFMLRNCYHR-AWEZNQCLSA-N	363.418	0.655	5	40	FCBB	
Cn1c(=N)c(C(=O)NC[C@H]2CCCO2)cc2c(=O)n3ccccc3nc21	100925259	VCZTXEXWBBGZLZ-LLVKDONJSA-N	353.382	0.574	5	40	FCBB	
Nc1ccc(S(=O)(=O)NCC(=O)O[C@@H]2CCCCC2=O)cc1[N+](=O)[O-]	9558276	RWKGBQRZZOJFBA-CYBMUJFWSA-N	371.371	0.510	5	40	FCBB	
CC1=C(C(N)=O)[C@@H](c2ccc([N+](=O)[O-])cc2)N2NC(CCCO)=NC2=N1	4294221	MXXJFLRYKXSXTF-CQSZACIVSA-N	358.358	0.756	5	40	FCBB	
CC(=O)N1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	6022442	NMOQVSVOQIJMCY-UHFFFAOYSA-N	362.386	0.736	5	40	FCBB	
CS(=O)(=O)N1CCC(Nc2ncc([N+](=O)[O-])c(NC3CC3)n2)CC1	44897953	ZPMXZMPCUNXOGZ-UHFFFAOYSA-N	356.408	0.795	5	40	FCBB	
CCOC(=O)N[C@@H]1CS(=O)(=O)C[C@H]1NCc1ccc([N+](=O)[O-])cc1	575419927	AVFFKKNPZFKQKI-CHWSQXEVSA-N	357.388	0.596	5	40	FCBB	
CC1(C)NC(=O)N(C[C@@H](O)COc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1=O	2280953	JOWNVSFNESNSHE-SECBINFHSA-N	368.302	0.573	5	40	FCBB	
CCOCCCn1c(=N)c(C(N)=O)cc2c(=O)n3cc(C)ccc3nc21	100811254	BNJGWAKJXGWBFM-UHFFFAOYSA-N	355.398	0.963	5	40	FCBB	
CCN(CC)CCNC(=O)c1nc(Cn2nc([N+](=O)[O-])cc2C)no1	17072864	OEWYXJGMUFOYEX-UHFFFAOYSA-N	351.367	0.603	5	40	FCBB	
O=C(NCCN1CCOCC1)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	13570439	ZIKRJQPYFIKWKX-UHFFFAOYSA-N	363.418	0.655	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@@]1(C)C=C[C@]2(CO)O1	4672921	RJWYYAXLVRFRJK-BQGCOEIASA-N	360.322	0.799	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N1CCOCC1)S(C)(=O)=O	10332716	LVQBAASLMAOMPE-UHFFFAOYSA-N	357.388	0.528	5	40	FCBB	
Nc1nc(NCCN2CCOCC2)nc(NC[C@@H]2CCCO2)c1[N+](=O)[O-]	20267263	ABCXQOUJDZQKLN-NSHDSACASA-N	367.410	0.302	5	40	FCBB	
NC(=O)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	33010885	NRCMBVYSHMAGTI-CYBMUJFWSA-N	368.415	0.833	5	40	FCBB	
COc1ccccc1Oc1nc([N+](=O)[O-])nn1CC(=O)N1CCOCC1	12371787	CTSFHSANSBEXGC-UHFFFAOYSA-N	363.330	0.846	5	40	FCBB	
CCOC(=O)CCNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	75107020	BVDQTPPFFALSTI-UHFFFAOYSA-N	360.344	0.598	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12	100998792	JNVZXBRAGGTWLW-MWLCHTKSSA-N	361.270	0.369	5	40	FCBB	
CNC(=O)c1cc2c(=O)n3cc(C)ccc3nc2n(CCCOC)c1=N	100627979	JRCUELRQRKZZGO-UHFFFAOYSA-N	355.398	0.833	5	40	FCBB	
CC(=O)N1C(=O)N(C[C@H](O)COc2ccc([N+](=O)[O-])cc2)C(=O)C1(C)C	3081948	LMYSKZYCESOZQA-LBPRGKRZSA-N	365.342	0.924	5	40	FCBB	
O=C(OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1CCCO1	25022083	BJWQITSIEOYXMB-HNNXBMFYSA-N	363.370	0.966	5	40	FCBB	
CCn1cc(S(=O)(=O)NCCCn2nc([N+](=O)[O-])cc2C)c(C)n1	36615087	GPMLLKFUWZYJDE-UHFFFAOYSA-N	356.408	0.993	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCS(=O)(=O)CC1	48301124	XVSHCKZQBGRUNR-UHFFFAOYSA-N	357.388	0.064	5	40	FCBB	
Nc1cccc(S(=O)(=O)N[C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	5616306	XJFZMYQMBQILKK-CABCVRRESA-N	367.383	0.550	5	40	FCBB	
CCOCCCn1c(=N)c(C(N)=O)cc2c(=O)n3cccc(C)c3nc21	100093373	LBRFVVULARKGGP-UHFFFAOYSA-N	355.398	0.963	5	40	FCBB	
CNS(=O)(=O)c1ccc(NCCCc2n[nH]c(N)n2)c([N+](=O)[O-])c1	72311000	ADKVQFHKNKKYAO-UHFFFAOYSA-N	355.380	0.248	5	40	FCBB	
C/C=C1/C[C@@H](C)[C@@](O)(CO)C(=O)OCC2=CC[N+]3([O-])CC[C@@H](OC1=O)[C@@H]23	34582473	IDIMIWQPUHURPV-OVRIUGMNSA-N	367.398	0.178	5	40	FCBB	
CC(=O)Oc1ccc(N2C(=O)[C@@H]3[C@H]4C=C[C@@](CO)(O4)[C@@H]3C2=O)cc1[N+](=O)[O-]	409059716	XFWQJMJWZUTCDS-WVZRYYJFSA-N	374.305	0.325	5	40	FCBB	
CS(=O)(=O)c1ccc(N2CCN(S(C)(=O)=O)CC2)c([N+](=O)[O-])c1	16738395	NJYKQDREVYZUBJ-UHFFFAOYSA-N	363.417	0.080	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1N(CC(=O)NCCN(C)C)S(C)(=O)=O	10111620	WXVUJHWPEZOUDN-UHFFFAOYSA-N	374.419	0.047	5	40	FCBB	
O=C(Cn1cc(Br)c([N+](=O)[O-])n1)NCC(=O)N1CCCC1	54919145	CKRAABIXJZUCMY-UHFFFAOYSA-N	360.168	0.292	5	40	FCBB	
CCNC(=O)CNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1	95349241	PXVUGIBGOIDDRP-VIFPVBQESA-N	352.322	0.339	5	40	FCBB	
CC1=C(C(N)=O)[C@H](c2cccc([N+](=O)[O-])c2)N2NC(CCCO)=NC2=N1	4294218	GQIZXUHPPJQPMT-AWEZNQCLSA-N	358.358	0.756	5	40	FCBB	
CCN(C(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	7202948	RGJLDSGXJVOSLH-MNOVXSKESA-N	357.388	0.793	5	40	FCBB	
CC[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@H](CC1)[C@H]32	5208229	LQHSJSDTMUEZFJ-QMAXYNQQSA-N	354.423	0.142	5	40	FCBB	
Cn1c(=O)c2c(nc3n2CC(c2cccc([N+](=O)[O-])c2)=NN3)n(C)c1=O	9210324	YBJJXZHILYOZPX-UHFFFAOYSA-N	355.314	0.172	5	40	FCBB	
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	69925485	OABYHZNAQACSLF-OAHLLOKOSA-N	357.370	0.907	5	40	FCBB	
CN(C)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C(N)=O)CC1	4182277	RSXQTRJKMDEQRB-UHFFFAOYSA-N	356.404	0.547	5	40	FCBB	
C[C@H]1CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C[C@H](C)O1	9291079	ZDFQJOCJVBCDIV-UWVGGRQHSA-N	356.383	0.001	5	40	FCBB	
NC(=O)[C@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)[C@@H](N)Cc1ccccc1	1579642	XGOKAPWRMOFBPN-KBPBESRZSA-N	372.381	0.383	5	40	FCBB	
CNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	24685785	NDISGSSMAJQLHU-NSHDSACASA-N	357.388	0.893	5	40	FCBB	
CNS(=O)(=O)c1ccc(NCCNc2ncccn2)c([N+](=O)[O-])c1	32913350	HLUYQPVRBMLCCI-UHFFFAOYSA-N	352.376	0.817	5	40	FCBB	
Nc1nonc1OCCNCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	6444517	ONNUKSOFJMALGI-UHFFFAOYSA-N	353.295	0.549	5	40	FCBB	
Cc1cc(NC(=O)COC(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)no1	3390303	IXJRUPFRNHHHEO-UHFFFAOYSA-N	362.298	0.803	5	40	FCBB	
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCC(NS(C)(=O)=O)CC1	8855929	YREQYIHPGSPJGD-NSHDSACASA-N	370.431	0.935	5	40	FCBB	
CC(C)(CNc1ccc([N+](=O)[O-])cc1S(N)(=O)=O)N1CCOCC1	15171413	MVBXIUXLHBGFEZ-UHFFFAOYSA-N	358.420	0.765	5	40	FCBB	
COc1cc(CCNC(=O)[C@H]2CC(=O)N(C)C2)c([N+](=O)[O-])cc1OC	40073895	WBDPNIUMGDBXPG-NSHDSACASA-N	351.359	0.749	5	40	FCBB	
Nc1ccccc1C1=NC(=O)[C@]2(CC(c3ccc([N+](=O)[O-])cc3)=NN2)NN1	12534116	NBOUAXLHGIUPMI-KRWDZBQOSA-N	365.353	0.652	5	40	FCBB	
CS(=O)(=O)N1CCCN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1	24922529	CFCDQWUBCIGXMN-UHFFFAOYSA-N	371.415	0.929	5	40	FCBB	
CCOc1ccc(NC(=O)COC(=O)[C@@H]2CCC(=O)N2)c([N+](=O)[O-])c1	5560137	DLEFTMNTRIWNLN-NSHDSACASA-N	351.315	0.754	5	40	FCBB	
CC(C)NS(=O)(=O)c1ccc(N2CCC(C(N)=O)CC2)c([N+](=O)[O-])c1	13038415	NHFNXNUZBMWWJD-UHFFFAOYSA-N	370.431	0.983	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]12	13711934	CQOUUWHVVWVIEL-ONGXEEELSA-N	361.270	0.369	5	40	FCBB	
CN(C)c1ccc(C(=O)N2CCCN(S(C)(=O)=O)CC2)cc1[N+](=O)[O-]	23174884	WHAPJUJJQAREHT-UHFFFAOYSA-N	370.431	0.768	5	40	FCBB	
C[C@H](O)[C@H](CCN[C@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	242677114	SYUWUHQRKQWNLI-WHOFXGATSA-N	370.427	0.941	5	40	FCBB	
C[C@H](O)C(=O)N[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H](C)C(=O)O	2060999843	CISRMXYNELRALT-HOTUBEGUSA-N	354.315	0.019	5	40	FCBB	
CC(=O)O[C@@H]1[C@@H](Oc2ccccc2[N+](=O)[O-])OC[C@@H](O)[C@H]1OC(C)=O	253492061	OPXWOTRGXPBRCG-REBRKWNGSA-N	355.299	0.554	5	40	FCBB	
CCCn1nnc(NC(=S)NC(=O)COc2ccc([N+](=O)[O-])cc2)n1	32119242	FHGXOROOXGITDA-UHFFFAOYSA-N	365.375	0.883	5	40	FCBB	
O=[N+]([O-])c1ccc(S(=O)(=O)N(C2CC2)[C@H]2CCS(=O)(=O)C2)cc1	45811096	LSUXQARQWCXYJB-LBPRGKRZSA-N	360.413	0.935	5	40	FCBB	
COc1cc(CCNC(=O)[C@@H]2CC(=O)N(C)C2)c([N+](=O)[O-])cc1OC	40073894	WBDPNIUMGDBXPG-LLVKDONJSA-N	351.359	0.749	5	40	FCBB	
Cc1cc([N+](=O)[O-])ccc1NS(=O)(=O)c1cn(C)c(=O)n(C)c1=O	223312672	HFIXZEWMUUEASE-UHFFFAOYSA-N	354.344	0.101	5	40	FCBB	
O=C(C[C@@H](NCCN1CCOCC1)C(=O)O)Nc1cccc([N+](=O)[O-])c1	23230081	LOBLHVSRRDZXPL-CQSZACIVSA-N	366.374	0.298	5	40	FCBB	
O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc1ncc([N+](=O)[O-])s1	10188032	GUVKQLZGXWXRCZ-UHFFFAOYSA-N	368.352	0.835	5	40	FCBB	
CCOc1cc([N+](=O)[O-])cc(/C=C2/NC(=O)N(CC(=O)O)C2=O)c1O	408596006	YOIIHOLPNHBAOT-RUDMXATFSA-N	351.271	0.676	5	40	FCBB	
COC(=O)C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl	2419691	OEIILTYEFZKJMZ-LLVKDONJSA-N	355.734	0.752	5	40	FCBB	
O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCS(=O)(=O)C1	47270323	LXIYKNWCXUYJFB-JTQLQIEISA-N	356.360	0.020	5	40	FCBB	
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NCC1(C(N)=O)CCOCC1	55246025	ZEMXPBLIHRQDPQ-UHFFFAOYSA-N	357.388	0.464	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@@H]1CCS(=O)(=O)C1	8186454	AOFWZGZQPSHQAY-LLVKDONJSA-N	357.388	0.661	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCN1CCN(C)CC1	13673210	QSHBWSRXZKCIKE-UHFFFAOYSA-N	356.448	0.819	5	40	FCBB	
NC(=O)c1ccc(NC[C@H]([C@@H]2CCOC2)N2CCOCC2)c([N+](=O)[O-])c1	24203983	YVYJQZQWHONVGJ-CZUORRHYSA-N	364.402	0.843	5	40	FCBB	
O=[N+]([O-])c1ccccc1N1CCN(C[C@@H](O)CN2CCOCC2)CC1	26712221	BTUUGZUAIWFJEO-OAHLLOKOSA-N	350.419	0.410	5	40	FCBB	
CS(=O)(=O)N1CC(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)C1	97102160	FSJQUPDUMHVSGJ-UHFFFAOYSA-N	354.388	0.783	5	40	FCBB	
O=C1OCC[C@H]1N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	37187808	QCCAUWAYJXUEKU-CYBMUJFWSA-N	355.372	0.217	5	40	FCBB	
CC(=O)OC[C@@]12C=C[C@@H](O1)[C@@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12	409303410	GYDGAVYOTXLVPT-UMPJEAMMSA-N	358.306	0.971	5	40	FCBB	
COC(=O)CSc1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2)n1C	2724049	VUGVWYLYUBSNET-UHFFFAOYSA-N	365.371	0.918	5	40	FCBB	
NS(=O)(=O)N1CCC(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)CC1	25268469	SCEQQYJDUPUKOU-UHFFFAOYSA-N	371.419	0.038	5	40	FCBB	
CC(C)C[C@H](Nc1nc2ccccn2c(=O)c1[N+](=O)[O-])C(=O)NCCO	79099280	KEFQUROKUXDEQI-NSHDSACASA-N	363.374	0.538	5	40	FCBB	
CC(C)[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@@H](C)C(=O)O[C@H](CC1)[C@@H]32	5208232	LZLZAYWNAJHXBF-RWHWLKSISA-N	368.450	0.531	5	40	FCBB	
O=C(OCC(=O)N1CCNC1=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	24913939	VYRALKCDMMBCSO-UHFFFAOYSA-N	362.342	0.904	5	40	FCBB	
CNc1ccc(S(=O)(=O)NCC(=O)OC[C@@H]2CCOC2)cc1[N+](=O)[O-]	50239701	PGUKGJSZWHBONV-SNVBAGLBSA-N	373.387	0.495	5	40	FCBB	
CN(C(=O)COC(=O)Cc1ccccc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	6913146	PENGBUDFUWTFER-GFCCVEGCSA-N	370.383	0.326	5	40	FCBB	
COC(=O)c1cc(C(=O)N(C)CCN2CCOC2=O)cc([N+](=O)[O-])c1	89346199	ILKFGRXNXHBOOK-UHFFFAOYSA-N	351.315	0.906	5	40	FCBB	
Cc1nn(CS(=O)(=O)CC(=O)NCc2ccco2)c(C)c1[N+](=O)[O-]	8782532	OVZZMIPWTVRBCR-UHFFFAOYSA-N	356.360	0.690	5	40	FCBB	
O=C(CNC(=O)c1ccco1)NCC(=O)OCc1ccc([N+](=O)[O-])cc1	1838837	GBPFFNBTCIQVIT-UHFFFAOYSA-N	361.310	0.777	5	40	FCBB	
CCC[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@H](CC1)[C@H]32	5208220	HFSOEXGLSDDQRJ-VSIUYGELSA-N	368.450	0.532	5	40	FCBB	
COc1cc(O)c([C@H](CO)[C@@H](O)CO)c2oc3cccc(O)c3c(=O)c12	14694896	WHNAJPFARNBVDZ-KCJUWKMLSA-N	362.334	0.795	5	40	FCBB	biogenic,in-vitro
O=C(COc1cc(F)ccc1[N+](=O)[O-])NCCN1C(=O)CSC1=O	3443496	ALOVARIHTZQILL-UHFFFAOYSA-N	357.319	0.924	5	40	FCBB	
CCN(C(=O)[C@H](C)Oc1cccnc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	7202951	RGJLDSGXJVOSLH-WDEREUQCSA-N	357.388	0.793	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1cnc2c(cnn2C)c1=O	9154231	MTOHWPSSNWVKBF-UHFFFAOYSA-N	358.314	0.686	5	40	FCBB	
NC(=O)c1ccc(NC[C@H]([C@H]2CCOC2)N2CCOCC2)c([N+](=O)[O-])c1	24203992	YVYJQZQWHONVGJ-XJKSGUPXSA-N	364.402	0.843	5	40	FCBB	
Cc1cc([N+](=O)[O-])ccc1N1C(=O)C[C@H](N2CCC(C(N)=O)CC2)C1=O	104015345	LVPQJWNYTQHCAM-AWEZNQCLSA-N	360.370	0.732	5	40	FCBB	
Cn1nnnc1Sc1ccc([N+](=O)[O-])c(Sc2nnnn2C)n1	8431044	OEBDOHQEIKUIOV-UHFFFAOYSA-N	352.365	0.339	5	40	FCBB	
NC(=O)c1cc([N+](=O)[O-])cn(CC(=O)N2CCC(c3ccccc3)=N2)c1=O	12755294	SBTLSTVXIXPDCD-UHFFFAOYSA-N	369.337	0.492	5	40	FCBB	
COCCNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1CCNC1=O	18025613	HNKNVBFZKPYNAC-UHFFFAOYSA-N	366.330	0.362	5	40	FCBB	
CCOc1cc(C(=O)OCc2nc(N)nc(N)n2)c([N+](=O)[O-])cc1OC	9337197	QPLIMGJBEDEDPV-UHFFFAOYSA-N	364.318	0.709	5	40	FCBB	
COc1c(O)ccc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])c1[N+](=O)[O-]	107700535	WSARKHZLRSKFKG-DUXPYHPUSA-N	350.243	0.764	5	40	FCBB	
CCOc1cc(C(=O)N[C@@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OC	17637348	UYXMCGQMKSPSKJ-SECBINFHSA-N	358.372	0.919	5	40	FCBB	
O=C1[C@@H]2[C@@H](C(=O)N1[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1	101678807	LBCYYMHCYKZZAX-NXWANJNESA-N	358.350	0.796	5	40	FCBB	
O=C(NC[C@@H](O)c1ccccc1)c1nc(Cn2ccc([N+](=O)[O-])n2)no1	12375980	YUJFTGBBHLUXPM-LLVKDONJSA-N	358.314	0.686	5	40	FCBB	
CCCCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@@H]1CCS(=O)(=O)C1	28187256	WTUQOSLMVOVEJE-CYBMUJFWSA-N	371.415	0.572	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@@H](NCCCO)C(=O)O)c([N+](=O)[O-])c1	4939762	BUOATONODACYQJ-GFCCVEGCSA-N	355.347	0.747	5	40	FCBB	
Nc1ccccc1C1=NC(=O)[C@@]2(CC(c3ccc([N+](=O)[O-])cc3)=NN2)NN1	12534117	NBOUAXLHGIUPMI-QGZVFWFLSA-N	365.353	0.652	5	40	FCBB	
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](O)CN1CCOCC1	83967281	MIRSDCWPXGTXAX-OCCSQVGLSA-N	369.443	0.885	5	40	FCBB	
Cn1c(N)c(C(=O)COc2ccc([N+](=O)[O-])cc2Cl)c(=O)n(C)c1=O	3356052	MFOAYUJOMAXNTH-UHFFFAOYSA-N	368.733	0.490	5	40	FCBB	
CCCn1nnnc1NC(=S)NC(=O)COc1ccccc1[N+](=O)[O-]	17075043	ZNRWESXQMATJGZ-UHFFFAOYSA-N	365.375	0.883	5	40	FCBB	
CN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@H]32)C1=O	9421893	PQQHISLDHXICJA-BLLLJJGKSA-N	360.326	0.051	5	40	FCBB	
O=C(NCCN(CCO)C(=O)c1cccc([N+](=O)[O-])c1)c1ccccn1	95115854	YTFBJXYJZIEFLU-UHFFFAOYSA-N	358.354	0.854	5	40	FCBB	
Cn1c(=O)[nH]c(=O)n(-c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc2)c1=O	5635086	YLIQWGRPIGOYGD-UHFFFAOYSA-N	356.294	0.925	5	40	FCBB	
O=C(O)CN1C[C@@]2([N+](=O)[O-])CC=C(Br)[C@]([N+](=O)[O-])(C1)C2	100083621	LJZUOANBIHOMFH-NXEZZACHSA-N	350.125	0.490	5	40	FCBB	
CNC(=O)NC(=O)CN1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1	35269199	OIEMWOSNCFSJBN-UHFFFAOYSA-N	372.385	0.721	5	40	FCBB	
COC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)OC)C(=O)C[C@]1(C)O	4099768	WGETYYLVMDBIRH-ZJOBFFGXSA-N	365.338	0.981	5	40	FCBB	
COC(=O)c1c([N+](=O)[O-])ncn1[C@H]1C[C@@H](OC(C)=O)[C@H](COC(C)=O)O1	4963337	NWWXMPJWFOFGCK-OUAUKWLOSA-N	371.302	0.360	5	40	FCBB	
CS(=O)(=O)N1CCN(c2cc(N3CCNCC3)ccc2[N+](=O)[O-])CC1	10012435	KAVWUDHKJZPHRR-UHFFFAOYSA-N	369.447	0.086	5	40	FCBB	
CCN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@@H]32)C1=O	13549761	FDRQYFWLVXZCSM-CXAGYDPISA-N	374.353	0.441	5	40	FCBB	
Cc1nn(C)c(C)c1CN1CCN(C(=O)c2nn(C)cc2[N+](=O)[O-])CC1	22276954	RKAABFQMSLHJNL-UHFFFAOYSA-N	361.406	0.637	5	40	FCBB	
CCn1c(=N)c(C(=O)NCCOC)cc2c(=O)n3cccc(C)c3nc21	100808817	CRNIMFMRXUWIKT-UHFFFAOYSA-N	355.398	0.833	5	40	FCBB	
O=C(CNC(=O)Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCS(=O)(=O)C1	47270321	LXIYKNWCXUYJFB-SNVBAGLBSA-N	356.360	0.020	5	40	FCBB	
Cc1ccc(C(=O)NCC(=O)NCC(=O)NCc2ccco2)cc1[N+](=O)[O-]	12615826	XARKZHYQQDFJIL-UHFFFAOYSA-N	374.353	0.659	5	40	FCBB	
CCN(C(=O)COC(=O)c1ccc([N+](=O)[O-])o1)[C@@H]1CCS(=O)(=O)C1	9612637	RYSBIHFVVOGTNY-SECBINFHSA-N	360.344	0.380	5	40	FCBB	
CS(=O)(=O)N1CCC(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	13005399	MCJBMWAWKANYGG-UHFFFAOYSA-N	363.417	0.297	5	40	FCBB	
Cc1c(S(=O)(=O)NCCCn2cc(Cl)c([N+](=O)[O-])n2)cnn1C	36614709	ZTEHRVRYCOWTSH-UHFFFAOYSA-N	362.799	0.855	5	40	FCBB	
CC(C)CS(=O)(=O)c1ccc([C@]2(O)C[N+](C)(CCO)CCO2)cc1	701977	SFJSXWSZLJMWSG-ZENAZSQFSA-N	358.480	0.731	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@H]1CCS(=O)(=O)C1	8186469	AOFWZGZQPSHQAY-NSHDSACASA-N	357.388	0.661	5	40	FCBB	
Cc1ccc(NC(=O)C[C@@H](NCCOCCO)C(=O)O)c([N+](=O)[O-])c1	39880993	GKCHUVYURZDUGM-GFCCVEGCSA-N	355.347	0.284	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1O[C@H](C)C(=O)N[C@H]1CCS(=O)(=O)C1	7827727	SWFGWHPBUGHJQI-ZJUUUORDSA-N	358.372	0.674	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@@H]1CCS(=O)(=O)C1	40005737	ZJDJHTZLHYCEDN-MRVPVSSYSA-N	350.374	0.069	5	40	FCBB	
CCn1ncc([N+](=O)[O-])c1C(=O)NCc1ccc(S(N)(=O)=O)cc1	2764634	AGRBROAMKRVBEG-UHFFFAOYSA-N	353.360	0.389	5	40	FCBB	
CC(C)[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@@H](C)C(=O)O[C@@H](CC1)[C@@H]32	5208234	LZLZAYWNAJHXBF-DHOBTACZSA-N	368.450	0.531	5	40	FCBB	
CCOC(=O)C1=NN[C@@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@H]12	4898504	RKHGLKNDPDRRCI-UWVGGRQHSA-N	366.717	0.629	5	40	FCBB	
CNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)NCC(=O)NC(C)C	7096519	RBINFVNMQOLZGD-UHFFFAOYSA-N	352.347	0.434	5	40	FCBB	
NS(=O)(=O)c1ccc(NCCC(=O)NCc2ccco2)c([N+](=O)[O-])c1	9322734	LTNCRZFBQREVJU-UHFFFAOYSA-N	368.371	0.954	5	40	FCBB	
COCCN1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C[C@H]1C	89512684	IIXXKGIWDCFDSL-GFCCVEGCSA-N	353.423	0.977	5	40	FCBB	
COC(=O)C1=NN[C@@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@H]12	100891751	CPYTXQKVQAIXMP-IUCAKERBSA-N	352.690	0.238	5	40	FCBB	
COCC(=O)NC1CCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	4909065	QUWDJORDIWTTIZ-UHFFFAOYSA-N	350.375	0.760	5	40	FCBB	
CNS(=O)(=O)CCC(=O)O[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	95452630	NDBYGBRQUSQENR-GFCCVEGCSA-N	371.371	0.183	5	40	FCBB	
NS(=O)(=O)c1ccc(C(=O)NCc2cccc(CO)c2)cc1[N+](=O)[O-]	572130864	KRPXQXZLTUZMIW-UHFFFAOYSA-N	365.367	0.665	5	40	FCBB	
NS(=O)(=O)c1ccc(NNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	16399673	YKVVGZWILGJPHS-UHFFFAOYSA-N	372.384	0.548	5	40	FCBB	
CS(=O)(=O)N[C@H]1CCCN(Cn2ncc3ccc([N+](=O)[O-])cc32)C1	48253829	KODYBEGZIVECAL-LBPRGKRZSA-N	353.404	0.916	5	40	FCBB	
N=C(N)NCCC[C@H](NC(=O)OCc1ccc([N+](=O)[O-])cc1)C(=O)O	644163637	AMKFUKMKVGMLAK-NSHDSACASA-N	353.335	0.537	5	40	FCBB	
NS(=O)(=O)c1ccc(CNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	12676301	JDDABIYRHDCUKN-UHFFFAOYSA-N	371.396	0.721	5	40	FCBB	
Nc1nc(Cl)c(/C=C/c2c([N+](=O)[O-])c(O)nn3cnnc23)c(=O)[nH]1	16546200	WBKBQAWRKLJAIT-OWOJBTEDSA-N	350.682	0.227	5	40	FCBB	
CC(=O)O[C@@H]1[C@H](Oc2ccccc2[N+](=O)[O-])OC[C@@H](O)[C@H]1OC(C)=O	96077815	OPXWOTRGXPBRCG-RZFFKMDDSA-N	355.299	0.554	5	40	FCBB	
CC[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	12521896	VLPPVSCNPBPHDM-LLVKDONJSA-N	359.404	0.799	5	40	FCBB	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCS(=O)(=O)C1	12905373	KXSMAFMBAZHTII-LLVKDONJSA-N	355.372	0.018	5	40	FCBB	
NS(=O)(=O)c1ccc(NC(=O)COc2cccnc2[N+](=O)[O-])cc1	6094717	SPQMHJKLEUYKCS-UHFFFAOYSA-N	352.328	0.655	5	40	FCBB	
CCn1c(Sc2c([N+](=O)[O-])ncn2C)nc2c1c(=O)n(C)c(=O)n2C	16839558	OGAQKQGFZRVJSJ-UHFFFAOYSA-N	365.375	0.247	5	40	FCBB	
NS(=O)(=O)[C@H]1CCCN(S(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)C1	95461705	JFHAFNRHPLJCMM-JTQLQIEISA-N	367.380	0.176	5	40	FCBB	
COC(=O)[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)OC)C(=O)C[C@]1(C)O	3903517	WGWCVBPRRCTFRR-ZJOBFFGXSA-N	365.338	0.981	5	40	FCBB	
CCN(C(=O)COc1ccc(C)nc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	5970268	XSHOGWIRROZTOC-NSHDSACASA-N	357.388	0.713	5	40	FCBB	
C[C@H]1CN(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	12610327	OKBNYZFIVWMKRO-TXEJJXNPSA-N	358.420	0.950	5	40	FCBB	
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cccc(CN2C(=O)CNC2=O)c1	40080688	MVFLNHGPQCLDBV-UHFFFAOYSA-N	358.314	0.482	5	40	FCBB	
Cn1c(=O)[nH]c(=O)c2c1nc1n2C[C@H](COc2ccc([N+](=O)[O-])cc2)O1	824568	MEHCKEQYOGJDKJ-SNVBAGLBSA-N	359.298	0.172	5	40	FCBB	
Cc1nn(CS(=O)(=O)CC(=O)NC[C@H]2CCCO2)c(C)c1[N+](=O)[O-]	8782659	DCGIPJKPHMNDRI-LLVKDONJSA-N	360.392	0.076	5	40	FCBB	
CCN(C(=O)COC(=O)c1ccc([N+](=O)[O-])o1)[C@H]1CCS(=O)(=O)C1	9612638	RYSBIHFVVOGTNY-VIFPVBQESA-N	360.344	0.380	5	40	FCBB	
Cc1nn(CC(=O)Nc2cnn(C)c2C(=O)NCC(C)C)cc1[N+](=O)[O-]	2731294	BSACMBQWGPTDQE-UHFFFAOYSA-N	363.378	0.858	5	40	FCBB	
O=C(NCC(=O)N1CCN(c2ncccn2)CC1)c1cccc([N+](=O)[O-])c1	15700826	SMMSMQHVJLNVLH-UHFFFAOYSA-N	370.369	0.463	5	40	FCBB	
CC1=NN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])C(=O)C1	100543010	YSEWOKHCDBYIIK-UHFFFAOYSA-N	368.371	0.728	5	40	FCBB	
Cc1c(C2=NO[C@@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@H]23)cnn1C	103507711	KMIAUIQYGONVBM-OCCSQVGLSA-N	355.310	0.929	5	40	FCBB	
CCOC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])o2)NC(=O)N[C@@]1(O)C(F)(F)F	3173307	UCHURUZOEPEFNH-LAEOZQHASA-N	367.236	0.972	5	40	FCBB	
CCN1CCN(c2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)O[C@H](C)C3)n2)CC1	5217004	NBWYJFRXOSUWEP-VXGBXAGGSA-N	365.438	0.723	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12	9330130	JNVZXBRAGGTWLW-ONGXEEELSA-N	361.270	0.369	5	40	FCBB	
COc1ccc(C(=O)N2CCCN(S(C)(=O)=O)CC2)cc1[N+](=O)[O-]	24777506	AYSBDVOPQGRTDT-UHFFFAOYSA-N	357.388	0.711	5	40	FCBB	
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC(NS(C)(=O)=O)CC1	11103885	IWZONWCRRGIXDR-LLVKDONJSA-N	370.431	0.935	5	40	FCBB	
Nc1nc2c(ncn2S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(=O)[nH]1	16385621	AADHHTRRHICSAG-UHFFFAOYSA-N	370.734	0.500	5	40	FCBB	
O=C(CCn1cnc([N+](=O)[O-])c1)NN1C(=O)NC2(CCCCC2)C1=O	12738334	MBXNOMZHJQWFHU-UHFFFAOYSA-N	350.335	0.467	5	40	FCBB	
O=C(N[C@H]1CCS(=O)(=O)C1)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	20647858	OZTGTSNRVCSOKC-LBPRGKRZSA-N	368.415	0.510	5	40	FCBB	
COC(=O)C1=NN(N=O)[C@]2(CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	9463704	MIGIQDJPEUTSCH-AWEZNQCLSA-N	361.270	0.513	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCN([C@H](C)CO)CC1	95407694	SHCZFPGBEHKIOQ-OLZOCXBDSA-N	366.418	0.929	5	40	FCBB	
COC(=O)CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])cc(OC)c2O)C1=O	408549810	ZMDGKOJJVFHKPQ-RUDMXATFSA-N	351.271	0.375	5	40	FCBB	
COC(=O)c1nc(N)nc(C(=O)OC)c1C(=O)c1cccc([N+](=O)[O-])c1	1588005	ALRVPSJKZUTSMT-UHFFFAOYSA-N	360.282	0.771	5	40	FCBB	
NC(=O)[C@H]1CC[C@H](CNC(=O)CCCNc2ccccc2[N+](=O)[O-])O1	84506981	VPZZTGPJNDAQLQ-BXUZGUMPSA-N	350.375	0.936	5	40	FCBB	
CCOc1ccc(NC(=O)COC(=O)[C@H]2CCC(=O)N2)c([N+](=O)[O-])c1	5560138	DLEFTMNTRIWNLN-LLVKDONJSA-N	351.315	0.754	5	40	FCBB	
CN1CCN([C@@H](CC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C(=O)O)CC1	65090398	XZVUOMPDTGHKIY-ZDUSSCGKSA-N	351.363	0.206	5	40	FCBB	
COC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC)[C@@H]1c1ccc([N+](=O)[O-])cc1	101646586	WGWCVBPRRCTFRR-VWPFQQQWSA-N	365.338	0.981	5	40	FCBB	
Cc1nn(C(F)F)c(C)c1S(=O)(=O)NCCn1ccc([N+](=O)[O-])n1	36614832	QWKJMVFWLBEXJU-UHFFFAOYSA-N	364.334	0.978	5	40	FCBB	
CCn1cc(S(=O)(=O)NC[C@H]2COc3ccccc3O2)c([N+](=O)[O-])n1	89305596	ROMOCXGKXNZCHA-JTQLQIEISA-N	368.371	0.930	5	40	FCBB	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)NC[C@H]1CCCO1	28828626	IDBDCSLCJVFJGB-GFCCVEGCSA-N	367.358	0.451	5	40	FCBB	
CN1CCN([C@H](CC(=O)Nc2ccc(N)c([N+](=O)[O-])c2)C(=O)O)CC1	65090399	XZVUOMPDTGHKIY-CYBMUJFWSA-N	351.363	0.206	5	40	FCBB	
O=[N+]([O-])c1cccc(S(=O)(=O)N2CCN(C[C@@H]3CCOCO3)CC2)c1	95956604	QCIIDCNGXOJCMH-AWEZNQCLSA-N	371.415	0.664	5	40	FCBB	
CN(CCS(=O)(=O)CCC(N)=O)Cc1cc([N+](=O)[O-])ccc1Cl	57531698	CLOMNTQHJVTCNN-UHFFFAOYSA-N	363.823	0.970	5	40	FCBB	
COC(=O)CCN1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	27194517	SVHNDNPXUINBRT-UHFFFAOYSA-N	357.388	0.464	5	40	FCBB	
Cn1c(=N)c(C(=O)NC[C@@H]2CCCO2)cc2c(=O)n3ccccc3nc21	100925255	VCZTXEXWBBGZLZ-NSHDSACASA-N	353.382	0.574	5	40	FCBB	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NC(=O)NCc1ccco1	3598556	ADTQRSAZVYNCLB-UHFFFAOYSA-N	372.293	0.810	5	40	FCBB	
O=C(CNC(=O)COc1ccccc1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	8770202	OUAFEFRGWGTSAZ-INIZCTEOSA-N	373.365	0.940	5	40	FCBB	
COc1ccc(S(=O)(=O)N2CCSC[C@H]2C(N)=O)c([N+](=O)[O-])c1	95461752	BTNKMVLCBNDYIF-JTQLQIEISA-N	361.401	0.195	5	40	FCBB	
Cc1nn(CC(=O)OCn2nnc3ccccc3c2=O)c(C)c1[N+](=O)[O-]	3414334	QDALMYVWUNTLEX-UHFFFAOYSA-N	358.314	0.714	5	40	FCBB	
C[C@H](O)C(=O)N[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H](C)C(=O)O	2060999842	CISRMXYNELRALT-AUTRQRHGSA-N	354.315	0.019	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H]1SC[C@@H](C(=O)O)NC1=O	3322352	GRJRUBAQGHMNCR-ONGXEEELSA-N	369.355	0.617	5	40	FCBB	
COCCCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N(C)C	58157607	OZYCHAZOFVWWEV-UHFFFAOYSA-N	352.391	0.886	5	40	FCBB	
CCOC(=O)C1=C(COC(=O)c2ccc([N+](=O)[O-])o2)NC(=O)N[C@@H]1C	22860038	VJDZDEKOSOSOFG-SSDOTTSWSA-N	353.287	0.863	5	40	FCBB	
CCN1CCN(c2nc(NCCCN(C)C)nc(N)c2[N+](=O)[O-])CC1	5157230	QHOSYYVLFVMDCD-UHFFFAOYSA-N	352.443	0.473	5	40	FCBB	
C[C@H](O)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	15209573	AFTFFGHVHHUMRJ-NSHDSACASA-N	358.420	0.324	5	40	FCBB	
CC(=O)OC[C@@]12C=C[C@@H](O1)[C@H]1C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12	6305662	GYDGAVYOTXLVPT-VMUDFCTBSA-N	358.306	0.971	5	40	FCBB	
CCn1cc(S(=O)(=O)NC[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])n1	89305595	ROMOCXGKXNZCHA-SNVBAGLBSA-N	368.371	0.930	5	40	FCBB	
COCCCNC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O	10335470	VYXBQHZTBVRXEV-UHFFFAOYSA-N	359.404	0.822	5	40	FCBB	
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(NS(C)(=O)=O)CC1	8708791	DJHYNGVFNJOHBC-UHFFFAOYSA-N	356.404	0.790	5	40	FCBB	
NS(=O)(=O)c1ccc(N2CCN(c3ncccn3)CC2)c([N+](=O)[O-])c1	8725983	YCCLLEDYAJDNEZ-UHFFFAOYSA-N	364.387	0.359	5	40	FCBB	
O=C(Cc1ccccc1[N+](=O)[O-])N1CCN(CC(=O)N2CCCC2)CC1	25194652	DMVBPWCUAXGLIS-UHFFFAOYSA-N	360.414	0.904	5	40	FCBB	
Cc1nc2nc[nH]n2c(=O)c1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	103683731	UIHKLAXZBYWYOA-UHFFFAOYSA-N	350.316	0.435	5	40	FCBB	
COc1cc(C(=O)OCC(=O)N2CCOCC2)c([N+](=O)[O-])cc1OC	2631961	ZFJULOTWUJEXNP-UHFFFAOYSA-N	354.315	0.628	5	40	FCBB	
O=C(O)CN1C[C@@]2([N+](=O)[O-])C[C@]([N+](=O)[O-])(CC=C2Br)C1	4535829	LJZUOANBIHOMFH-ZJUUUORDSA-N	350.125	0.490	5	40	FCBB	
COc1ccc(S(=O)(=O)N2C[C@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1	40135555	YPVPMMJHXDMEND-VHSXEESVSA-N	357.388	0.878	5	40	FCBB	
CNc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2CCOC2)cc1[N+](=O)[O-]	50239702	PGUKGJSZWHBONV-JTQLQIEISA-N	373.387	0.495	5	40	FCBB	
CCOC(=O)N[C@@H]1CS(=O)(=O)C[C@@H]1NCc1ccc([N+](=O)[O-])cc1	575419929	AVFFKKNPZFKQKI-QWHCGFSZSA-N	357.388	0.596	5	40	FCBB	
C[C@H]1C[C@H](C)CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C1	5164618	VKSAWWBQJJTCGW-QWRGUYRKSA-N	354.411	0.870	5	40	FCBB	
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCC(C(=O)N2CCOCC2)CC1	40083044	MYAAAUWBFZJWOS-UHFFFAOYSA-N	363.374	0.164	5	40	FCBB	
Cc1cccc(C(=O)OCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)c1[N+](=O)[O-]	3351956	UNJUPGPXBUAIRJ-LLVKDONJSA-N	370.383	0.706	5	40	FCBB	
CS(=O)(=O)c1nnc(NC(=O)COc2ccc([N+](=O)[O-])cc2)s1	13624325	GQCNGQPEUHCKKU-UHFFFAOYSA-N	358.357	0.867	5	40	FCBB	
CS(=O)(=O)N1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)CC1	44683828	DSLVXWVTCDHHEO-UHFFFAOYSA-N	370.431	0.891	5	40	FCBB	
C[C@H](O)[C@H](CCN[C@@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	217339519	SYUWUHQRKQWNLI-LNSITVRQSA-N	370.427	0.941	5	40	FCBB	
C[C@@H]1C[C@@H](C)CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C1	5164620	VKSAWWBQJJTCGW-GHMZBOCLSA-N	354.411	0.870	5	40	FCBB	
O=C(Cn1cnc2c(cnn2CCO)c1=O)Nc1cccc([N+](=O)[O-])c1	10188019	KMESIWRGQKEBSM-UHFFFAOYSA-N	358.314	0.132	5	40	FCBB	
COc1cc(OCC(=O)NCCCN2CCOCC2)ccc1[N+](=O)[O-]	69125635	BOLVDFVFGNETMT-UHFFFAOYSA-N	353.375	0.821	5	40	FCBB	
COCC(=O)NC1CCN(CC(=O)Nc2ccccc2[N+](=O)[O-])CC1	4909013	SQBZODJRFRAUFH-UHFFFAOYSA-N	350.375	0.760	5	40	FCBB	
CCOC(=O)C1=NN[C@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]12	100831114	RKHGLKNDPDRRCI-NXEZZACHSA-N	366.717	0.629	5	40	FCBB	
NC(=O)[C@@H]1CC[C@H](CNC(=O)CCCNc2ccccc2[N+](=O)[O-])O1	84506988	VPZZTGPJNDAQLQ-RISCZKNCSA-N	350.375	0.936	5	40	FCBB	
O=C(C[C@H](NCCN1CCOCC1)C(=O)O)Nc1cccc([N+](=O)[O-])c1	23230084	LOBLHVSRRDZXPL-AWEZNQCLSA-N	366.374	0.298	5	40	FCBB	
C=CC(=O)N(CC)CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	1628486285	JXAGEAVVBFXHQP-UHFFFAOYSA-N	374.397	0.914	5	40	FCBB	
Cc1nnc(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n(N)c1=O	3309128	XNKQPOGJHVKMIH-UHFFFAOYSA-N	354.323	0.439	5	40	FCBB	
C[C@@H](CNS(=O)(=O)CCc1ccc([N+](=O)[O-])cc1)N1CCN(C)CC1	95428057	DWCDXEQMHVFFBC-AWEZNQCLSA-N	370.475	0.693	5	40	FCBB	
CC(=O)OCCN(c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-]	103781591	XCQAXLAFHYZAPE-UHFFFAOYSA-N	359.207	0.972	5	40	FCBB	
Nc1ccccc1C1=NC(=O)[C@]2(CC(c3cccc([N+](=O)[O-])c3)=NN2)NN1	12554447	DRANNCIEFCKUPI-KRWDZBQOSA-N	365.353	0.652	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@H](NC[C@H](C)O)C(=O)O)c([N+](=O)[O-])c1	5258773	XCMOIWYHJHVFFS-CABZTGNLSA-N	355.347	0.746	5	40	FCBB	
CC(=O)NCCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCOCC1	9338776	WPYYPKKIJGXBIJ-UHFFFAOYSA-N	372.403	0.164	5	40	FCBB	
COC(=O)C1=NN[C@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@H]12	100891750	CPYTXQKVQAIXMP-DTWKUNHWSA-N	352.690	0.238	5	40	FCBB	
CNc1ccc([N+](=O)[O-])cc1C(=O)NCCN1CCS(=O)(=O)CC1	58161489	KNHFTUKKXPLJNT-UHFFFAOYSA-N	356.404	0.097	5	40	FCBB	
O=C(NC[C@H](O)c1ccccc1)c1nc(Cn2cc([N+](=O)[O-])cn2)no1	12375979	MJZPFWQQTAANNN-LBPRGKRZSA-N	358.314	0.686	5	40	FCBB	
O=c1c2cc3c(=O)n(-n4cnnc4)ccc3nc2ccn1-c1ccncc1	38829259	SFPPKNIHFNCDNZ-UHFFFAOYSA-N	357.333	0.999	5	40	FCBB	
Cn1c(=O)[nH]c(=O)c2c1nc1n2C[C@@H](COc2ccc([N+](=O)[O-])cc2)O1	824569	MEHCKEQYOGJDKJ-JTQLQIEISA-N	359.298	0.172	5	40	FCBB	
CCOC(=O)[C@H]1Cc2c([nH]c(=O)[nH]c2=O)O[C@@H]1c1ccc([N+](=O)[O-])cc1	1575186	FQCZDYNWLAHGCW-CMPLNLGQSA-N	361.310	0.827	5	40	FCBB	
O=C1[C@H]2[C@H]3C=C[C@@](C4OCCO4)(O3)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1	409294978	NIJKFIBEQYEGOZ-ZOPJHEKZSA-N	358.306	0.781	5	40	FCBB	
CS(=O)(=O)N1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	24508132	URHSQBUEHPSMPH-UHFFFAOYSA-N	367.387	0.722	5	40	FCBB	
NC(=O)[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)[C@H](N)Cc1ccccc1	1579645	XGOKAPWRMOFBPN-ZIAGYGMSSA-N	372.381	0.383	5	40	FCBB	
CC(=O)N1CCN(C(=O)COC(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	7506980	URPNDRWVLNBNFW-VOTSOKGWSA-N	361.354	0.842	5	40	FCBB	
COCCNC(=O)CN(C)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	8747657	YJXRDKBXESHOEB-UHFFFAOYSA-N	350.375	0.686	5	40	FCBB	
CCOC(=O)c1ccc(N2CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])CC2)nc1	95978279	DGCIFXRGRFJAAP-UHFFFAOYSA-N	374.357	0.852	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(C)C=C[C@@]2(CO)O1	408975020	IPXHQMYZAOJLPK-IXKJSCDLSA-N	360.322	0.799	5	40	FCBB	
CCN1CCN(c2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])CC1	4305986	ULPMRUSKRYRAGZ-LLVKDONJSA-N	351.411	0.700	5	40	FCBB	
COC(=O)CCN1CCN(S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)CC1	12794246	YIAYGGBUKRBANN-UHFFFAOYSA-N	371.415	0.773	5	40	FCBB	
Cc1c(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)cccc1[N+](=O)[O-]	25206630	PPVRUHWCZYNBQH-UHFFFAOYSA-N	356.404	0.467	5	40	FCBB	
NS(=O)(=O)c1cc(N2CCC(NC(=O)C3CC3)CC2)cc([N+](=O)[O-])c1	58131102	OQQPYJJDUNORRZ-UHFFFAOYSA-N	368.415	0.737	5	40	FCBB	
O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)NC(=O)NCc1ccco1	8883495	CDPGZTMFQKVKSS-UHFFFAOYSA-N	371.309	0.924	5	40	FCBB	
CS(=O)(=O)N[C@@H]1CCCN(Cn2ncc3ccc([N+](=O)[O-])cc32)C1	48253827	KODYBEGZIVECAL-GFCCVEGCSA-N	353.404	0.916	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCCCN(C)C)S(C)(=O)=O	10334755	XTTMHLNQHPWLRC-UHFFFAOYSA-N	372.447	0.737	5	40	FCBB	
CNC(=O)c1cc2c(=O)n3cc(C)ccc3nc2n(C[C@@H]2CCCO2)c1=N	16742592	FIZODWYJZHWECL-LBPRGKRZSA-N	367.409	0.976	5	40	FCBB	
COc1ccc(NC(=O)C[C@H]2SC[C@@H](C(=O)O)NC2=O)c([N+](=O)[O-])c1	15910125	BEJHFWGJGMABNV-GXSJLCMTSA-N	369.355	0.617	5	40	FCBB	
Cc1nc(C)c(CC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(=O)[nH]1	31370732	GROJYHSZGARLSQ-UHFFFAOYSA-N	372.385	0.581	5	40	FCBB	
COC(=O)CN1CCCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	79048605	HKEMTGLNNGXPSF-UHFFFAOYSA-N	371.415	0.605	5	40	FCBB	
O=C1CN(S(=O)(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1	199774153	KVECAIRLBSGTER-UHFFFAOYSA-N	353.278	0.734	5	40	FCBB	
COC(=O)C1=NN(N=O)[C@@]2(CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	9463706	MIGIQDJPEUTSCH-CQSZACIVSA-N	361.270	0.513	5	40	FCBB	
O=C(CN1CCCCC1)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	20508248	NISIVTPARHUMCT-UHFFFAOYSA-N	370.431	0.475	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCNC[C@@H]2c2ccccc2)n1	599099682	JGIDTQWEFLLWDV-GFCCVEGCSA-N	351.388	0.664	5	40	FCBB	
O=S1(=O)CC[N+]2(CCN(c3ccc(Br)cn3)CC2)CC1	1615610192	AGAHECUEHXSHAP-UHFFFAOYSA-N	361.285	0.909	5	40	FCBB	
CCN1CCN(c2nc(N)c([N+](=O)[O-])c(NC[C@H]3CCCO3)n2)CC1	4306191	UNKDPSPIXUZAGR-LLVKDONJSA-N	351.411	0.700	5	40	FCBB	
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1NCCOCCO	6788156	UFFDXXORMBTPBC-UHFFFAOYSA-N	359.404	0.800	5	40	FCBB	
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1	2805221	RMYZXERTCMAOJO-ZWNOBZJWSA-N	365.302	0.061	5	40	FCBB	biogenic,in-vitro
COC(=O)[C@H]1[C@@H](c2ccc([N+](=O)[O-])cc2)[C@@H](C(=O)OC)C(=O)C[C@@]1(C)O	3903518	WGWCVBPRRCTFRR-SZOQZIPDSA-N	365.338	0.981	5	40	FCBB	
CCOc1cc(/C=C2/NC(=O)N(CC(=O)O)C2=O)cc([N+](=O)[O-])c1O	408589596	DYXMSOBYCVUDEL-FPYGCLRLSA-N	351.271	0.676	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N[C@H]1CCS(=O)(=O)C1	40005738	ZJDJHTZLHYCEDN-QMMMGPOBSA-N	350.374	0.069	5	40	FCBB	
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1	69925482	OABYHZNAQACSLF-HNNXBMFYSA-N	357.370	0.907	5	40	FCBB	
CS(=O)(=O)c1ccc(SCC(=O)N2CCOCC2)c([N+](=O)[O-])c1	1475700	DNKBTZJLEMICOU-UHFFFAOYSA-N	360.413	0.949	5	40	FCBB	
O=C(c1ccccc1)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	24154607	HVDQKCVZAPLYEL-UHFFFAOYSA-N	356.338	0.881	5	40	FCBB	
Cc1cc(C)n2c(n1)nc(=O)c1cc(S(=O)(=O)N3CCOCC3)ccc12	4709762	YXOCVHDWHYNDJA-UHFFFAOYSA-N	374.422	0.880	5	40	FCBB	
CC[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@@H](CC1)[C@H]32	5208230	LQHSJSDTMUEZFJ-QDMNXMHASA-N	354.423	0.142	5	40	FCBB	
CN(C(=O)COC(=O)Cc1ccccc1[N+](=O)[O-])[C@H]1CCS(=O)(=O)C1	6913240	PENGBUDFUWTFER-LBPRGKRZSA-N	370.383	0.326	5	40	FCBB	
Cc1cc(N)n(-c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])n1	13146907	KNMSARSUIUNVNI-UHFFFAOYSA-N	367.387	0.692	5	40	FCBB	
COc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(CO)C=C[C@@]3(C)O2)c([N+](=O)[O-])c1	408733444	JIEZJPKCXDEIFS-KFZJALRRSA-N	360.322	0.799	5	40	FCBB	
CS(=O)(=O)N[C@H]1CCCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	58081371	PTTRASLLBHXYJH-JTQLQIEISA-N	370.387	0.474	5	40	FCBB	
CC1=C(C(N)=O)[C@@H](c2cccc([N+](=O)[O-])c2)N2NC(CCCO)=NC2=N1	4294220	GQIZXUHPPJQPMT-CQSZACIVSA-N	358.358	0.756	5	40	FCBB	
C[C@H](Cn1cccn1)NC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21	24806793	TUJTVZMIMBESET-LLVKDONJSA-N	359.342	0.722	5	40	FCBB	
COc1ccc(C(=O)OCC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	9612684	GDCXTLQWNCSESW-SNVBAGLBSA-N	372.355	0.064	5	40	FCBB	
COC(=O)c1cc(C(=O)NCCCN2CCOCC2)cc([N+](=O)[O-])c1	25330226	XXIOJFJUTXFGCN-UHFFFAOYSA-N	351.359	0.834	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)N1CCN(C)CC1)S(C)(=O)=O	22874136	VCPRVGVAIWWXSI-UHFFFAOYSA-N	370.431	0.443	5	40	FCBB	
Cc1nn(CC(=O)Nc2cccc(S(N)(=O)=O)c2)c(C)c1[N+](=O)[O-]	8692500	LRLKBHPXGBKTLZ-UHFFFAOYSA-N	353.360	0.694	5	40	FCBB	
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCS(=O)(=O)C1	12905376	KXSMAFMBAZHTII-NSHDSACASA-N	355.372	0.018	5	40	FCBB	
C[C@H](OC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(=O)NC1CC1	4538907	YSVZMAGVDHMMHG-QMMMGPOBSA-N	356.356	0.822	5	40	FCBB	
COc1cc(O)c([C@H](CO)[C@H](O)CO)c2oc3cccc(O)c3c(=O)c12	14694900	WHNAJPFARNBVDZ-LDYMZIIASA-N	362.334	0.795	5	40	FCBB	biogenic,in-vitro
CC1(C)CC2(CCO1)N1CC3([N+](=O)[O-])CN2CC([N+](=O)[O-])(C1)C3(C)C	19324308	AVJAZQHHRYFHHN-UHFFFAOYSA-N	354.407	0.974	5	40	FCBB	
Nc1nc(NCCN2CCOCC2)nc(NCc2ccco2)c1[N+](=O)[O-]	20357477	FRIZSPAIXVNATG-UHFFFAOYSA-N	363.378	0.916	5	40	FCBB	
Cn1c(=O)c2c(ncn2CCCOc2ccc([N+](=O)[O-])cc2)n(C)c1=O	48366870	BHVUVEWZJSUIHJ-UHFFFAOYSA-N	359.342	0.811	5	40	FCBB	
CC1(C)C2([N+](=O)[O-])CN3CC1([N+](=O)[O-])CN(C2)C3c1ccc([N+](=O)[O-])o1	19319717	KFCDJGNSVJAASB-UHFFFAOYSA-N	367.318	0.888	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@H]12	100998793	JNVZXBRAGGTWLW-KOLCDFICSA-N	361.270	0.369	5	40	FCBB	
COC(=O)CN1C(=O)N/C(=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)C1=O	408548925	NMVYEKVPSDOXIS-FPYGCLRLSA-N	366.242	0.274	5	40	FCBB	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@@H](O)CN1CCOCC1	83967284	MIRSDCWPXGTXAX-GXTWGEPZSA-N	369.443	0.885	5	40	FCBB	
COC(CN1CC2=C(C1=O)[C@H](c1ccc([N+](=O)[O-])cc1)NC(=O)N2)OC	8755447	YKLPBHGJHUPTFX-AWEZNQCLSA-N	362.342	0.664	5	40	FCBB	
CCOC(=O)N1CCN(C(=O)COC(=O)c2ccc([N+](=O)[O-])o2)CC1	9634880	RTYKYJYFFQGWFZ-UHFFFAOYSA-N	355.303	0.645	5	40	FCBB	
CC[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	12521895	VLPPVSCNPBPHDM-NSHDSACASA-N	359.404	0.799	5	40	FCBB	
CNC(=O)c1cc2c(=O)n3cc(C)ccc3nc2n(C[C@H]2CCCO2)c1=N	16742593	FIZODWYJZHWECL-GFCCVEGCSA-N	367.409	0.976	5	40	FCBB	
N=c1c(C(N)=S)cc2c(=O)n3ccccc3nc2n1C[C@H]1CCCO1	100894054	FVNPMFWRDBRBBR-SNVBAGLBSA-N	355.423	0.942	5	40	FCBB	
O=[N+]([O-])OCCN(c1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-])[N+](=O)[O-]	100926659	UNMSQGCYXOMOAC-UHFFFAOYSA-N	362.167	0.618	5	40	FCBB	
CCOC(=O)[C@@H]1[C@H](c2ccc([N+](=O)[O-])o2)NC(=O)N[C@]1(O)C(F)(F)F	5447453	UCHURUZOEPEFNH-DKCNOQQISA-N	367.236	0.972	5	40	FCBB	
CS(=O)(=O)NC[C@H]1CCCN(c2ncc([N+](=O)[O-])c(NC3CC3)n2)C1	29627350	KMESHWXWKNPTLS-SNVBAGLBSA-N	370.435	0.725	5	40	FCBB	
COc1ccc(NC(=O)CN2CCN([C@@H](C)CO)CC2)c([N+](=O)[O-])c1	72313885	IWNLQXSOPWBVMI-LBPRGKRZSA-N	352.391	0.540	5	40	FCBB	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H](CO)C1CCC1	597923567	SMIOCRBEKBPQGZ-AWEZNQCLSA-N	371.415	0.540	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@@H]2CC(=O)N(C(C)C)C2)c([N+](=O)[O-])c1	60362910	VQTVQCGMAFRTDE-SNVBAGLBSA-N	356.404	0.924	5	40	FCBB	
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NC(=O)NC1CCCC1	3598553	DXFYBOVPPOILCN-UHFFFAOYSA-N	360.326	0.959	5	40	FCBB	
COC(=O)C1=NN[C@@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]12	4940243	CPYTXQKVQAIXMP-BDAKNGLRSA-N	352.690	0.238	5	40	FCBB	
O=C(Cn1cnc2c(cnn2CCO)c1=O)Nc1ccc([N+](=O)[O-])cc1	10188020	SREUOKQOHIBRPE-UHFFFAOYSA-N	358.314	0.132	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCN(C(C)=O)CC1	24710748	SDDYEQNGBSSHEN-UHFFFAOYSA-N	357.388	0.846	5	40	FCBB	
Cc1nn(CC(=O)OCC(=O)NC(=O)c2cccs2)c(C)c1[N+](=O)[O-]	32671956	VTEHSULPRRGFMR-UHFFFAOYSA-N	366.355	0.969	5	40	FCBB	
Nc1ccc(S(=O)(=O)NCC(=O)O[C@H]2CCCCC2=O)cc1[N+](=O)[O-]	9558277	RWKGBQRZZOJFBA-ZDUSSCGKSA-N	371.371	0.510	5	40	FCBB	
COC(=O)c1cc([N+](=O)[O-])cn(CN2CCN(c3cnccn3)CC2)c1=O	32935508	RAGDKIPPDPMTAF-UHFFFAOYSA-N	374.357	0.113	5	40	FCBB	
CCOC(=O)C(=O)c1cc(C(=O)C(=O)OCC)c([N+](=O)[O-])cc1[N+](=O)[O-]	4265541	XBDCUJZSLBKLHT-UHFFFAOYSA-N	368.254	0.995	5	40	FCBB	biogenic
CC(=O)Oc1ccc(N2C(=O)[C@H]3[C@H]4C=C[C@@](CO)(O4)[C@@H]3C2=O)cc1[N+](=O)[O-]	409059706	XFWQJMJWZUTCDS-FHIRATQRSA-N	374.305	0.325	5	40	FCBB	
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cn1nnc2ccccc2c1=O	14674232	RFMFOIWZLNCAJB-UHFFFAOYSA-N	351.278	0.953	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@@H]1C(=O)N(C)C	24712410	LMUJZLWSKVVCCS-LLVKDONJSA-N	357.388	0.845	5	40	FCBB	
Cc1ccc(C(=O)OCC(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	3361952	GUACKBGTXUSZRN-GFCCVEGCSA-N	370.383	0.706	5	40	FCBB	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)NC[C@@H]1CCCO1	28828625	IDBDCSLCJVFJGB-LBPRGKRZSA-N	367.358	0.451	5	40	FCBB	
CCS(=O)(=O)N(C)C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	58151744	FGFHXMJCKILJQT-UHFFFAOYSA-N	357.388	0.853	5	40	FCBB	
Cc1c(C(=O)OCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)cccc1[N+](=O)[O-]	6200721	IMLKQMVPJPZECL-NSHDSACASA-N	370.383	0.706	5	40	FCBB	
CNC(=O)NC(=O)CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	31304459	QORMZJNEUAEKKZ-UHFFFAOYSA-N	355.782	0.826	5	40	FCBB	
NS(=O)(=O)c1cccc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1	9464645	AWPVNOWAESBVPG-UHFFFAOYSA-N	352.328	0.043	5	40	FCBB	
CN(CC(=O)NCC(F)(F)F)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	56070171	WDXCPRJISMFODS-UHFFFAOYSA-N	355.294	0.894	5	40	FCBB	
CS(=O)(=O)c1nnc(NC(=O)COc2ccccc2[N+](=O)[O-])s1	13628735	BGTWVNOKRUIHCB-UHFFFAOYSA-N	358.357	0.867	5	40	FCBB	
CS(=O)(=O)NC[C@@H]1CCCN(c2ncc([N+](=O)[O-])c(NC3CC3)n2)C1	29627348	KMESHWXWKNPTLS-JTQLQIEISA-N	370.435	0.725	5	40	FCBB	
CC(C)(C)C(=O)COC(=O)CNS(=O)(=O)c1ccc(N)c([N+](=O)[O-])c1	9955526	PDULSDNBNSQYOE-UHFFFAOYSA-N	373.387	0.614	5	40	FCBB	
Cc1ccc(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)cc1[N+](=O)[O-]	25204777	CZCRLTUERXARLH-UHFFFAOYSA-N	356.404	0.467	5	40	FCBB	
O=C(Cn1ccc([N+](=O)[O-])n1)NCCN1CCN(c2ccccc2)CC1	43272349	XBHYQDOCATYADI-UHFFFAOYSA-N	358.402	0.730	5	40	FCBB	
COc1ccc(S(=O)(=O)NCC(C)(C)N2CCOCC2)c([N+](=O)[O-])c1	32895568	JYALCXCSFBVKGT-UHFFFAOYSA-N	373.431	0.993	5	40	FCBB	
CCOc1cc([N+](=O)[O-])cc(/C=C2/NC(=O)N(CC(=O)OC)C2=O)c1O	408549125	PLDAGVSLPQNPON-BJMVGYQFSA-N	365.298	0.765	5	40	FCBB	
C[C@H]1CN(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])C[C@@H](C)O1	12561496	KAKIVGBSZDHING-TXEJJXNPSA-N	358.420	0.950	5	40	FCBB	
COC(=O)C1=NN(C(C)=O)[C@]2(CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1	9075547	JTLPYGQPVBMDGX-INIZCTEOSA-N	374.309	0.378	5	40	FCBB	
CN1CCN(C(=O)c2cc3c(=O)n4ccccc4nc3n(C)c2=N)CC1	2428465	BYIUGGKFGUCQMD-UHFFFAOYSA-N	352.398	0.053	5	40	FCBB	
CN(Cc1ccccc1F)C(=O)Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	40050082	KIPODBCUAMYVHL-UHFFFAOYSA-N	362.317	0.653	5	40	FCBB	
COC(=O)c1cc([N+](=O)[O-])c(N(CC(=O)O)CC(=O)O)c([N+](=O)[O-])c1	2382214992	UHAHOBWLRVWMOS-UHFFFAOYSA-N	357.231	0.265	5	40	FCBB	
COc1ccc(CN(C)C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cc1	27053730	LIXTVZBAVSUKJD-UHFFFAOYSA-N	374.353	0.523	5	40	FCBB	
O=c1[nH]c(=O)c2ccc3c(=O)n(C[C@H]4CCCO4)c(=O)c4ccc1c2c43	227116805	DVXWWEAZRKOGMG-SECBINFHSA-N	350.330	0.771	5	40	FCBB	
COc1ccc(S(=O)(=O)N2C[C@@H](C(N)=O)CC[C@@H]2C)c([N+](=O)[O-])c1	40135553	YPVPMMJHXDMEND-UWVGGRQHSA-N	357.388	0.878	5	40	FCBB	
C[C@H]1CN(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	12610328	OKBNYZFIVWMKRO-RYUDHWBXSA-N	358.420	0.950	5	40	FCBB	
CCn1nc(C)c2nnn(CC(=O)Nc3cccc([N+](=O)[O-])c3)c(=O)c21	96182372	SAKJHGBYQBIUQE-UHFFFAOYSA-N	357.330	0.863	5	40	FCBB	
COC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	32770728	DYTBJERKGZQHDH-VIFPVBQESA-N	357.344	0.020	5	40	FCBB	
Cc1c(C(=O)N[C@H](CCC(=O)O)C(=O)O)cc([N+](=O)[O-])cc1[N+](=O)[O-]	4181857	LLTHVYKEMSOTEY-SECBINFHSA-N	355.259	0.859	5	40	FCBB	
CCN(CC)CCCNc1nc(N)c([N+](=O)[O-])c(N2CCN(C)CC2)n1	5155586	RQQMHVLTYUYZGL-UHFFFAOYSA-N	366.470	0.863	5	40	FCBB	
O=C(NC1CC1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	12947531	NKYJCBOJEOLKGY-UHFFFAOYSA-N	354.388	0.773	5	40	FCBB	
N=C1S/C(=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)C(=O)N1c1nonc1N	12375203	SKHWKMNAAVKNOX-DPZRFJKGSA-N	373.310	0.938	5	40	FCBB	
CN(C)c1ccc(C(=O)NC2CCN(S(C)(=O)=O)CC2)cc1[N+](=O)[O-]	36393456	COZRRXFGVNWHHM-UHFFFAOYSA-N	370.431	0.815	5	40	FCBB	
COCCN1CCN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)C[C@@H]1C	89512688	IIXXKGIWDCFDSL-LBPRGKRZSA-N	353.423	0.977	5	40	FCBB	
NC(=O)c1ccc(NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c([N+](=O)[O-])c1	24203987	YVYJQZQWHONVGJ-BBRMVZONSA-N	364.402	0.843	5	40	FCBB	
Cc1c(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc([N+](=O)[O-])cc1[N+](=O)[O-]	4181856	LLTHVYKEMSOTEY-VIFPVBQESA-N	355.259	0.859	5	40	FCBB	
CC(=O)Oc1ccc(N2C(=O)[C@H]3[C@H](C2=O)[C@@]2(CO)C=C[C@H]3O2)cc1[N+](=O)[O-]	409059713	XFWQJMJWZUTCDS-WBOJAVRRSA-N	374.305	0.325	5	40	FCBB	
O=C(COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)NCc1ccco1	3303251	SMTDPYJTVGTWRJ-UHFFFAOYSA-N	361.310	0.777	5	40	FCBB	
CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](/C=C/[N+](=O)[O-])OC(C)=O	4915982	ULOLEEKLIUKACL-VQQHFMJTSA-N	361.303	0.135	5	40	FCBB	
C[N+](C)(C)CCOC(=O)CCSCCC(=O)OCC[N+](C)(C)C	4837353	SXBGREIQCOEAAR-UHFFFAOYSA-N	350.525	0.999	5	40	FCBB	
CN(CC(=O)NCC(F)(F)F)S(=O)(=O)c1ccccc1[N+](=O)[O-]	56070173	FBXAJYCDYVJKDQ-UHFFFAOYSA-N	355.294	0.894	5	40	FCBB	
CC1(C)NC(=O)N(C[C@H](O)COc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1=O	2280952	JOWNVSFNESNSHE-VIFPVBQESA-N	368.302	0.573	5	40	FCBB	
CCOC(=O)N[C@H]1CS(=O)(=O)C[C@H]1NCc1ccc([N+](=O)[O-])cc1	575419928	AVFFKKNPZFKQKI-OLZOCXBDSA-N	357.388	0.596	5	40	FCBB	
O=C(OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1CCCO1	25022087	BJWQITSIEOYXMB-OAHLLOKOSA-N	363.370	0.966	5	40	FCBB	
C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC(NS(C)(=O)=O)CC1	11104466	VFEJBYRWFUOORC-LLVKDONJSA-N	370.431	0.935	5	40	FCBB	
CNC(=O)CCN(C)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	65562642	ACRMFNHCOBYCDM-UHFFFAOYSA-N	370.431	0.952	5	40	FCBB	
O=C1[C@@H]2[C@@H](C(=O)N1[C@@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1	101678801	LBCYYMHCYKZZAX-JBDWTNTLSA-N	358.350	0.796	5	40	FCBB	
Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCNC(=O)C2)nc1	40089077	WAJWOMKIODPIBY-UHFFFAOYSA-N	356.342	0.882	5	40	FCBB	
COC(=O)CN1C(=O)N/C(=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)C1=O	408549647	WEYHKXVXOPECQX-FPYGCLRLSA-N	351.271	0.375	5	40	FCBB	
O=C1C(=O)N(CN(CCCO[N+](=O)[O-])[N+](=O)[O-])c2ccc([N+](=O)[O-])cc21	100093827	SATXRKWRRFYQML-UHFFFAOYSA-N	369.246	0.174	5	40	FCBB	
CCn1cc(NC(=O)CCn2cc(Cl)c([N+](=O)[O-])n2)c(C(N)=O)n1	2781146	GDZWYIUPNFOTPZ-UHFFFAOYSA-N	355.742	0.789	5	40	FCBB	
NC(=O)[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)[C@@H](N)Cc1ccccc1	1579644	XGOKAPWRMOFBPN-UONOGXRCSA-N	372.381	0.383	5	40	FCBB	
Cc1cc(NC(=O)Cn2cnc([N+](=O)[O-])c2)n([C@H]2CCS(=O)(=O)C2)n1	31804841	IYKPCDLGTKPTRV-JTQLQIEISA-N	368.375	0.295	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@@]1(C)CCS(=O)(=O)C1	25908023	MPKJOPNWXBDREO-AWEZNQCLSA-N	357.388	0.709	5	40	FCBB	
COC(=O)CN(CC(=O)OC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	57837193	QBAXMHIQHBOPON-UHFFFAOYSA-N	363.330	0.459	5	40	FCBB	
COC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)c2c(=O)n(C)c(=O)n(C)c2n1	4685973	ICSCWTAKODLSMF-UHFFFAOYSA-N	370.321	0.994	5	40	FCBB	
O=C(COC(=O)/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1	2640142	BVLZUPUTDINQBI-BTDICHCPSA-N	368.367	0.455	5	40	FCBB	
CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](/C=C/[N+](=O)[O-])OC(C)=O	4915994	ULOLEEKLIUKACL-LHHWMGCDSA-N	361.303	0.135	5	40	FCBB	
Cc1cc([N+](=O)[O-])c(NC[C@@H](O)[C@@H](O)[C@H](O)CO)cc1Br	4774500	LSZRKFXYHZKZCR-IJLUTSLNSA-N	365.180	0.153	5	40	FCBB	
Cn1ccnc1[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccccc1F	40152596	NIHFSONTLJBZGW-CYBMUJFWSA-N	359.321	0.965	5	40	FCBB	
CCn1nc(C)c(S(=O)(=O)NCCCn2ccc([N+](=O)[O-])n2)c1C	36614971	MGXSNJDRIGQTBL-UHFFFAOYSA-N	356.408	0.993	5	40	FCBB	
CNC(=O)c1nnn2c1sc1c(C(=O)NC)nnn1c1ccccc12	1409703	ZESWMRSABNFKLS-UHFFFAOYSA-N	356.371	0.268	5	40	FCBB	
Cc1cccc(C(=O)OCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)c1[N+](=O)[O-]	5228068	UNJUPGPXBUAIRJ-NSHDSACASA-N	370.383	0.706	5	40	FCBB	
C[C@@H]1CN=C(N2CCN(C(=O)c3cc([N+](=O)[O-])cnc3N)CC2)S1	96007122	MJQGUJKFVQBCMZ-SECBINFHSA-N	350.404	0.821	5	40	FCBB	
CNC(=O)[C@@H]1CN(C(=O)CCn2cnc([N+](=O)[O-])c2)c2ccccc2O1	25349984	DCDQZAISWCMFOZ-ZDUSSCGKSA-N	359.342	0.722	5	40	FCBB	
CC1=C(C(N)=O)[C@H](c2ccc([N+](=O)[O-])cc2)N2NC(CCCO)=NC2=N1	1795263	MXXJFLRYKXSXTF-AWEZNQCLSA-N	358.358	0.756	5	40	FCBB	
CCN(CC)C(=O)COC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	3436818	MIRKUXVQBIDPJO-UHFFFAOYSA-N	363.326	0.602	5	40	FCBB	
O=c1oc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2c2ccccc12	4073649	WNWBIUMUTUWNJA-DIKXUDHVSA-N	374.345	0.125	5	40	FCBB	biogenic
O=C(Cn1cc([N+](=O)[O-])cn1)NCCN1CCN(Cc2ccccc2)CC1	32760353	LQBDTTXBZASMIN-UHFFFAOYSA-N	372.429	0.725	5	40	FCBB	
CN(C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCS(=O)(=O)C1	12942886	NYCCEPDBPVFIMA-CYBMUJFWSA-N	369.399	0.360	5	40	FCBB	
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCN(S(C)(=O)=O)CC1	15400764	ITTURPCHTNTXNB-NSHDSACASA-N	356.404	0.499	5	40	FCBB	
NCCOCCOCCOCCOCCOc1ccc([N+](=O)[O-])cc1	1774020990	QRXXGASYSVINNJ-UHFFFAOYSA-N	358.391	0.999	5	40	FCBB	
O=[N+]([O-])c1cnn(CN2CCN(c3nnnn3-c3ccccc3)CC2)c1	58161684	FXUWHZOJWOKJJC-UHFFFAOYSA-N	355.362	0.547	5	40	FCBB	
Cc1ccc(N2C(=O)C[C@@H](N3CCC(C(N)=O)CC3)C2=O)cc1[N+](=O)[O-]	101982759	QXQABHUSWAUMQN-CQSZACIVSA-N	360.370	0.732	5	40	FCBB	
COc1ccc(N2C(=O)[C@H]3[C@@H](C2=O)[C@@]2(C)C=C[C@@]3(CO)O2)c([N+](=O)[O-])c1	408733443	JIEZJPKCXDEIFS-IXKJSCDLSA-N	360.322	0.799	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cn(C)c(=O)n(C)c1=O	223312237	LDUIYURAHQYBBP-UHFFFAOYSA-N	354.344	0.101	5	40	FCBB	
CNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	24685790	NDISGSSMAJQLHU-LLVKDONJSA-N	357.388	0.893	5	40	FCBB	
CCN(C(=O)[C@@H](C)Oc1cccnc1[N+](=O)[O-])[C@@H]1CCS(=O)(=O)C1	7202947	RGJLDSGXJVOSLH-GHMZBOCLSA-N	357.388	0.793	5	40	FCBB	
CO[C@H](C)C(=O)N1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	48286580	UBEBHXPNMLGPIU-LLVKDONJSA-N	371.415	0.682	5	40	FCBB	
CCOc1cc(C(=O)N[C@H]2CCS(=O)(=O)C2)c([N+](=O)[O-])cc1OC	17637351	UYXMCGQMKSPSKJ-VIFPVBQESA-N	358.372	0.919	5	40	FCBB	
CN1CCN2c3ccc([N+](=O)[O-])cc3C[C@@]3(C(=O)N(C)C(=O)N=C3O)[C@@H]2C1	36110378	ZBYMYDKOQQZGAL-SUMWQHHRSA-N	373.369	0.806	5	40	FCBB	
Cc1cccn2c(=O)c3cc(C(=O)NC[C@H]4CCCO4)c(=N)n(C)c3nc12	100926774	KUQRLLCOLKZRNU-GFCCVEGCSA-N	367.409	0.883	5	40	FCBB	
CN1C(=O)N(C)C(=O)C(Nc2ccc([N+](=O)[O-])cc2)(SCCO)C1=O	5393003	MWOMTELXHKEHDM-UHFFFAOYSA-N	368.371	0.479	5	40	FCBB	
O=C1NC(=O)[C@H]2CN(c3ccc([N+](=O)[O-])c(N4CCOCC4)c3F)C[C@@H]12	566807275	KRUTXCOPUSBVSY-AOOOYVTPSA-N	364.333	0.279	5	40	FCBB	
COC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@@H](C(=O)OC)[C@H]1c1cccc([N+](=O)[O-])c1	4099774	WGETYYLVMDBIRH-ZOMKSWQUSA-N	365.338	0.981	5	40	FCBB	
O=c1oc2cc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)ccc2c2ccccc12	2104110	WNWBIUMUTUWNJA-LVEJAMMSSA-N	374.345	0.125	5	40	FCBB	
CN(C)c1nc(N)nc(CN2CCN(c3ccc([N+](=O)[O-])nc3)CC2)n1	40086168	GQOJCYZBVWCFHF-UHFFFAOYSA-N	359.394	0.145	5	40	FCBB	
CCN1CCN(c2nc(N)c([N+](=O)[O-])c(NC[C@@H]3CCCO3)n2)CC1	4306188	UNKDPSPIXUZAGR-NSHDSACASA-N	351.411	0.700	5	40	FCBB	
O=C(Cn1ccc([N+](=O)[O-])n1)NCCNC(=O)c1ccccc1Cl	48301834	BCXLANTVDBRAQR-UHFFFAOYSA-N	351.750	0.991	5	40	FCBB	
C[S@](=O)CCN1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	76020591	MWJOVAOYRLEKQV-XMMPIXPASA-N	355.416	0.496	5	40	FCBB	
O=C(CN1CCCC1)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	20508245	OCCXOIXGSWOFJS-UHFFFAOYSA-N	356.404	0.085	5	40	FCBB	
CN1C(=O)N(C)C(=O)C2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@H]32)C1=O	5354957	VEAKSLKXRROIST-ZDUSSCGKSA-N	374.353	0.393	5	40	FCBB	
O=C1C[C@@H](NS(=O)(=O)c2ccc(Br)cc2[N+](=O)[O-])CN1	95941914	RYPQOSYQNAAGFC-SSDOTTSWSA-N	364.177	0.524	5	40	FCBB	
CCOC(=O)CCNC(=O)CCNC(=O)c1ccc(O)c([N+](=O)[O-])c1	1589427	XRNKCKCTLJETGQ-UHFFFAOYSA-N	353.331	0.490	5	40	FCBB	
O=C(CNC(=O)c1ccco1)NCC(=O)OCc1cccc([N+](=O)[O-])c1	6526543	RBWZDQNKSMORAG-UHFFFAOYSA-N	361.310	0.777	5	40	FCBB	
COC[C@H](C)NC(=O)CN(c1cc([N+](=O)[O-])ccc1C)S(C)(=O)=O	10323930	SLXPFFWFSPTHNX-NSHDSACASA-N	359.404	0.820	5	40	FCBB	
CCCn1nnc(NC(=S)NC(=O)COc2ccccc2[N+](=O)[O-])n1	32118629	UWYVBYJJKUNLFQ-UHFFFAOYSA-N	365.375	0.883	5	40	FCBB	
COc1ccc(S(=O)(=O)NCCNc2c([N+](=O)[O-])ncn2C)cc1	24215908	XICBWVFFHCRYSP-UHFFFAOYSA-N	355.376	0.727	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@]1(CO)C=C[C@]2(C)O1	100377201	RJWYYAXLVRFRJK-UTJXIGIESA-N	360.322	0.799	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1N1C(=O)[C@H]2[C@H](C1=O)[C@@]1(CO)C=C[C@@]2(C)O1	408975022	IPXHQMYZAOJLPK-KFZJALRRSA-N	360.322	0.799	5	40	FCBB	
CCOC(=O)CS(=O)(=O)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	2684984	XCZJOKDGHINEFY-UHFFFAOYSA-N	351.358	0.335	5	40	FCBB	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@@H]2CCS(=O)(=O)C2)c1C	44789943	BHQBSFFRMLVIPR-NSHDSACASA-N	362.429	0.925	5	40	FCBB	
CCN(CC)C(=O)[C@H]1CSCN1C(=O)c1ccc([N+](=O)[O-])c(N)n1	95469005	MXYZULIIKKSZAI-LLVKDONJSA-N	353.404	0.956	5	40	FCBB	
CNC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)NC)[C@H]1c1cccc([N+](=O)[O-])c1	15081136	FLDMLTBKDNCSFC-LOUJCGABSA-N	363.370	0.127	5	40	FCBB	
CCOc1cc(/C=C2/NC(=O)N(CC(=O)OC)C2=O)cc([N+](=O)[O-])c1O	108973670	WVJMKBUHXFENGG-RUDMXATFSA-N	365.298	0.765	5	40	FCBB	
CCOC(=O)Cn1nc(C)c(NC(=O)Cn2ccc([N+](=O)[O-])n2)c1C	1426698	OZGYJIMWVFXUQD-UHFFFAOYSA-N	350.335	0.806	5	40	FCBB	
CCCn1c(N)c(C(=O)COc2cc(F)ccc2[N+](=O)[O-])c(=O)[nH]c1=O	3446386	ZWLANZPRRWEHRA-UHFFFAOYSA-N	366.305	0.838	5	40	FCBB	
O=C(CN1CCOCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	14085734	HMCITDWEKDRLGJ-UHFFFAOYSA-N	362.386	0.211	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NCC(=O)N[C@]1(C)CCS(=O)(=O)C1	25908030	MPKJOPNWXBDREO-CQSZACIVSA-N	357.388	0.709	5	40	FCBB	
CCOC(=O)[C@@H]1[C@@H](c2ccc([N+](=O)[O-])o2)NC(=O)N[C@@]1(O)C(F)(F)F	15905949	UCHURUZOEPEFNH-RNSXUZJQSA-N	367.236	0.972	5	40	FCBB	
C[C@H]1CN(c2nc(N)c([N+](=O)[O-])c(N3CCN(C)CC3)n2)C[C@@H](C)O1	5111906	VSVLOVLJQPPIQS-PHIMTYICSA-N	351.411	0.332	5	40	FCBB	
COc1ccc(NC(=O)CN2CCN([C@H](C)CO)CC2)c([N+](=O)[O-])c1	72313886	IWNLQXSOPWBVMI-GFCCVEGCSA-N	352.391	0.540	5	40	FCBB	
C[C@H](O)[C@@H](CCN[C@H]1CCS(=O)(=O)C1)C(=O)c1ccc([N+](=O)[O-])cc1	242677112	SYUWUHQRKQWNLI-CORIIIEPSA-N	370.427	0.941	5	40	FCBB	
O=C(COc1cccnc1[N+](=O)[O-])N1CCN(C(=O)c2ccco2)CC1	13107575	XEYYFBJKZGAUIO-UHFFFAOYSA-N	360.326	0.946	5	40	FCBB	
O=C(CCn1cc(Br)cn1)NCCn1cc([N+](=O)[O-])cn1	2774999	LNMJACTYIZOBIK-UHFFFAOYSA-N	357.168	0.957	5	40	FCBB	
CNC(=O)c1cc2c(=O)n3ccccc3nc2n(C[C@@H]2CCCO2)c1=N	100809698	MCKCHLFROXPZDQ-NSHDSACASA-N	353.382	0.667	5	40	FCBB	
Cc1nc(N2CCN(CCO)CC2)nc(N2CCCCC2)c1[N+](=O)[O-]	38488497	ZKVLHFGNHTUSLG-UHFFFAOYSA-N	350.423	0.798	5	40	FCBB	
O=C1[C@H]2[C@@H](C(=O)N1c1cccc([N+](=O)[O-])c1)[C@H]1C=C[C@@]2(C2OCCO2)O1	409294972	NIJKFIBEQYEGOZ-IPJQOSJUSA-N	358.306	0.781	5	40	FCBB	
Cc1nnc2n(c1=O)[C@H](CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CS2	10034871	KGWMJPSAUOEZSB-JTQLQIEISA-N	368.396	0.976	5	40	FCBB	
CS(=O)(=O)c1ccc(C(=O)OCC(=O)N2CCCC2=O)cc1[N+](=O)[O-]	3503284	CARSJHUTJMRNOU-UHFFFAOYSA-N	370.339	0.304	5	40	FCBB	
CCOC(=O)[C@@H]1Cc2c([nH]c(=O)[nH]c2=O)O[C@H]1c1ccc([N+](=O)[O-])cc1	1575185	FQCZDYNWLAHGCW-PWSUYJOCSA-N	361.310	0.827	5	40	FCBB	
CN(C)C(=O)CN(C)c1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	8746843	JQVQSZSNHWUNRD-UHFFFAOYSA-N	370.431	0.904	5	40	FCBB	
CS(=O)(=O)N1CCC(NS(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	13015834	PMAZLCLSBOOZBR-UHFFFAOYSA-N	363.417	0.297	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NCCCN1CCOCC1	23105446	TXLATRUWRVXTLL-UHFFFAOYSA-N	350.375	0.680	5	40	FCBB	
CCC[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@@H](CC1)[C@H]32	5208221	HFSOEXGLSDDQRJ-OJIKIQFZSA-N	368.450	0.532	5	40	FCBB	
Cc1ccc(C(=O)OCC(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	5975425	GUACKBGTXUSZRN-LBPRGKRZSA-N	370.383	0.706	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1O[C@H](C)C(=O)N[C@@H]1CCS(=O)(=O)C1	7827719	SWFGWHPBUGHJQI-NXEZZACHSA-N	358.372	0.674	5	40	FCBB	
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[C@@H]1SC(NC(=N)N)=NC1=O	20028246	FQCWUTRKMQTMTK-VIFPVBQESA-N	350.360	0.713	5	40	FCBB	
NC(=O)c1ccc(NCCc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])c1	5637594	YIGJUPYAAMPDKV-UHFFFAOYSA-N	364.383	0.996	5	40	FCBB	
Cn1cc(CN2CCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)CC2)cn1	20614090	NPSVHTHDDMLANK-UHFFFAOYSA-N	365.415	0.835	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC[C@H]1C(=O)N(C)C	24712413	LMUJZLWSKVVCCS-NSHDSACASA-N	357.388	0.845	5	40	FCBB	
CCOc1cc([N+](=O)[O-])c(C(=O)OCc2nc(N)nc(N)n2)cc1OC	12598844	KNIUOUOHZMDDAL-UHFFFAOYSA-N	364.318	0.709	5	40	FCBB	
COc1cc(/C=C/c2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cc([N+](=O)[O-])c1O	6906053	PGBFVGNAVLWLTN-NSCUHMNNSA-N	350.243	0.764	5	40	FCBB	
C[C@H]1CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C[C@@H](C)O1	13810751	ZDFQJOCJVBCDIV-AOOOYVTPSA-N	356.383	0.001	5	40	FCBB	
COc1cc(NC(=O)CNC(=O)C(=O)NCC(C)C)c(C)cc1[N+](=O)[O-]	14121166	YKTNTRIYDXZYSF-UHFFFAOYSA-N	366.374	0.739	5	40	FCBB	
NC(=O)[C@H](Cc1ccc(O)c([N+](=O)[O-])c1)NC(=O)[C@H](N)Cc1ccccc1	1579643	XGOKAPWRMOFBPN-KGLIPLIRSA-N	372.381	0.383	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@@H](NC[C@@H](C)O)C(=O)O)c([N+](=O)[O-])c1	5258772	XCMOIWYHJHVFFS-BXKDBHETSA-N	355.347	0.746	5	40	FCBB	
Nc1ncnc(N2CC(=O)N(CCc3ccccc3)C(=O)C2)c1[N+](=O)[O-]	3912694	JELQLMOHAUJFBI-UHFFFAOYSA-N	356.342	0.385	5	40	FCBB	
Cc1nn(CCC(=O)N2CCN(c3nccn3C)CC2)c(C)c1[N+](=O)[O-]	84013886	QLNRISGSVDJAON-UHFFFAOYSA-N	361.406	0.881	5	40	FCBB	
NC(=O)COCCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-]	84350809	OSUQEHMEFUFDEM-UHFFFAOYSA-N	353.303	0.505	5	40	FCBB	
C[C@@H]1CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C[C@@H](C)O1	9291080	ZDFQJOCJVBCDIV-NXEZZACHSA-N	356.383	0.001	5	40	FCBB	
CCCn1nnnc1NC(=S)NC(=O)COc1ccc([N+](=O)[O-])cc1	17075044	YVMVMOBYPGSRQH-UHFFFAOYSA-N	365.375	0.883	5	40	FCBB	
CNC(=O)[C@H]1[C@@H](c2cccc([N+](=O)[O-])c2)[C@@H](C(=O)NC)C(=O)C[C@]1(C)O	36619668	FLDMLTBKDNCSFC-ZJOBFFGXSA-N	363.370	0.127	5	40	FCBB	
O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)N[C@H](CO)C1CCC1	597923568	SMIOCRBEKBPQGZ-CQSZACIVSA-N	371.415	0.540	5	40	FCBB	
CNc1ccc(C(=O)OCC(=O)NC(=O)NCCCOC)cc1[N+](=O)[O-]	9581201	DMINAEHPOHDZSI-UHFFFAOYSA-N	368.346	0.656	5	40	FCBB	
COc1ccc(NC(=O)C[C@@H]2SC[C@@H](C(=O)O)NC2=O)c([N+](=O)[O-])c1	15910123	BEJHFWGJGMABNV-ONGXEEELSA-N	369.355	0.617	5	40	FCBB	
O=C(NCCN1CCOCC1)c1ccc2nc3ccccc3c(=O)n2c1	20646326	OCWFDRCWJVBDMQ-UHFFFAOYSA-N	352.394	0.910	5	40	FCBB	
COc1ccc(NC(=O)NC[C@@H](O)CN2CCOCC2)c([N+](=O)[O-])c1	32796846	SUEGCEXQBNGGOZ-LLVKDONJSA-N	354.363	0.418	5	40	FCBB	
CC1(C)C2([N+](=O)[O-])CN3CC1([N+](=O)[O-])CN(C2)C31C(=O)Nc2ccccc21	19318704	RIRJJBYCMJTMDE-UHFFFAOYSA-N	373.369	0.494	5	40	FCBB	
Cc1cc([N+](=O)[O-])ccc1NC(=O)C[C@H]1SC(NC(=N)N)=NC1=O	20028247	FQCWUTRKMQTMTK-SECBINFHSA-N	350.360	0.713	5	40	FCBB	
O=C(NC(=S)NCCCN1CCOCC1)c1ccc([N+](=O)[O-])cc1	20058041	IGUGITXZXOZVEI-UHFFFAOYSA-N	352.416	0.921	5	40	FCBB	
COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)NCCN1CCN(C)CC1	4718292	GTQXUSIVGXZMNG-UHFFFAOYSA-N	365.434	0.647	5	40	FCBB	
COC(=O)CN1C(=O)/C(=C/c2cc(OC)c(O)c([N+](=O)[O-])c2)NC1=S	409217268	UGIRCQZNQUNNOO-BAQGIRSFSA-N	367.339	0.540	5	40	FCBB	
Cc1c(C2=NO[C@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@H]23)cnn1C	103507708	KMIAUIQYGONVBM-TZMCWYRMSA-N	355.310	0.929	5	40	FCBB	
O=C(Cn1cnc2c(Cl)cc([N+](=O)[O-])cc2c1=O)N1CCOCC1	563113991	XNZCYNKLDZITJP-UHFFFAOYSA-N	352.734	0.817	5	40	FCBB	
Cc1c(NC(=O)CCN2CCN(S(C)(=O)=O)CC2)cccc1[N+](=O)[O-]	26338226	GTVXRADLGCJKDF-UHFFFAOYSA-N	370.431	0.809	5	40	FCBB	
O=C1[C@@H]2[C@@H](C(=O)N1[C@H](CO)[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1	101678803	LBCYYMHCYKZZAX-HPYGTKAVSA-N	358.350	0.796	5	40	FCBB	
NC(=O)CN1C(=O)[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)c2ccccc21	4555104	UKBHYADKXVQYDO-SFHVURJKSA-N	369.333	0.887	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@H](NC[C@@H](C)O)C(=O)O)c([N+](=O)[O-])c1	5258771	XCMOIWYHJHVFFS-SKDRFNHKSA-N	355.347	0.746	5	40	FCBB	
Cc1cc([N+](=O)[O-])ccc1N1C(=O)C[C@@H](N2CCC(C(N)=O)CC2)C1=O	17074199	LVPQJWNYTQHCAM-CQSZACIVSA-N	360.370	0.732	5	40	FCBB	
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(=O)n(C)c(=O)n1C	11236653	UWXRGWGBLUKFCI-UHFFFAOYSA-N	362.342	0.415	5	40	FCBB	
Cn1c(=N)c(C(=O)NCc2cccnc2)cc2c(=O)n3ccccc3nc21	2376176	XVFGUVPGJDNLQG-UHFFFAOYSA-N	360.377	0.991	5	40	FCBB	
NS(=O)(=O)[C@@H]1CCCN(S(=O)(=O)c2cc(F)cc([N+](=O)[O-])c2)C1	95461706	JFHAFNRHPLJCMM-SNVBAGLBSA-N	367.380	0.176	5	40	FCBB	
CN1CCN(CCCNS(=O)(=O)Cc2cccc([N+](=O)[O-])c2)CC1	216401720	IHGWMEORSLQELC-UHFFFAOYSA-N	356.448	0.652	5	40	FCBB	
Cc1c(NS(=O)(=O)c2cn(C)c(=O)n(C)c2=O)cccc1[N+](=O)[O-]	223312335	CAEVMBMDIWSINK-UHFFFAOYSA-N	354.344	0.101	5	40	FCBB	
CC(C)[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@H](CC1)[C@@H]32	5208231	LZLZAYWNAJHXBF-ZRCSZXNASA-N	368.450	0.531	5	40	FCBB	
CCS(=O)(=O)NCCCNS(=O)(=O)c1cccc(F)c1[N+](=O)[O-]	51162403	GLRFYJKBYZQIDA-UHFFFAOYSA-N	369.396	0.342	5	40	FCBB	
COCCn1c(=N)c(C(=O)NC(C)C)cc2c(=O)n3ccccc3nc21	101137087	QZWKUSRBKMYMTE-UHFFFAOYSA-N	355.398	0.913	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]12	101001296	CQOUUWHVVWVIEL-KOLCDFICSA-N	361.270	0.369	5	40	FCBB	
CO[C@@H](C)C(=O)N1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	48286578	UBEBHXPNMLGPIU-NSHDSACASA-N	371.415	0.682	5	40	FCBB	
COC(=O)C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl	2419690	OEIILTYEFZKJMZ-NSHDSACASA-N	355.734	0.752	5	40	FCBB	
COC(=O)CC[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)C(=O)OC	3061425	UEVGXLPCMMQAMK-LLVKDONJSA-N	360.344	0.368	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@@]1(CO)C=C[C@]2(C)O1	4672920	RJWYYAXLVRFRJK-OMNBBPDLSA-N	360.322	0.799	5	40	FCBB	
COc1cc(O)c([C@@H](CO)[C@H](O)CO)c2oc3cccc(O)c3c(=O)c12	14694898	WHNAJPFARNBVDZ-GZMMTYOYSA-N	362.334	0.795	5	40	FCBB	biogenic,in-vitro
CCCCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)[C@H]1CCS(=O)(=O)C1	28187257	WTUQOSLMVOVEJE-ZDUSSCGKSA-N	371.415	0.572	5	40	FCBB	
Cc1ccc(NC(=O)C[C@H](NCCOCCO)C(=O)O)c([N+](=O)[O-])c1	39880992	GKCHUVYURZDUGM-LBPRGKRZSA-N	355.347	0.284	5	40	FCBB	
COc1nn(CCC(=O)N2N=CC[C@]2(O)C(F)(F)F)cc1[N+](=O)[O-]	6641084	JPSJHZVDJMQWPB-JTQLQIEISA-N	351.241	0.659	5	40	FCBB	
CN1C(=O)NC(=O)[C@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@@H]32)C1=O	8974945	PQQHISLDHXICJA-MLGOLLRUSA-N	360.326	0.051	5	40	FCBB	
Cc1nn(C)c(N2CCN(CC(=O)N3CCCCC3)CC2)c1[N+](=O)[O-]	47331127	NDJOUPNIYUDUKN-UHFFFAOYSA-N	350.423	0.771	5	40	FCBB	
COC(=O)C[C@H](NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C)C(=O)OC	72277413	VNRCQKVYZLPECR-JTQLQIEISA-N	356.335	0.019	5	40	FCBB	
COC(=O)CN1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	79048609	UEHGIJKSRUJFSZ-UHFFFAOYSA-N	371.415	0.773	5	40	FCBB	
Cc1c([N+](=O)[O-])cc(C(=O)Nc2cc(=O)n(C)c(=O)n2C)cc1[N+](=O)[O-]	17074705	MAGYTUZMKJIZTA-UHFFFAOYSA-N	363.286	0.461	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1CCN([C@@H](C)CO)CC1	95407693	SHCZFPGBEHKIOQ-STQMWFEESA-N	366.418	0.929	5	40	FCBB	
CC[C@H](C)NC(=O)CN1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	29531980	VTJHULKJTOSXQX-LBPRGKRZSA-N	363.418	0.730	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CC(=O)NC[C@@H]2c2ccccc2)n1	1561953860	DZUWRLUQJYVLDI-LLVKDONJSA-N	365.371	0.190	5	40	FCBB	
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC[C@H](O)CN1CCOCC1	83967279	MIRSDCWPXGTXAX-JSGCOSHPSA-N	369.443	0.885	5	40	FCBB	
O=C(Cn1nc([N+](=O)[O-])nc1Oc1ccccc1F)N1CCOCC1	4722266	VIAIISUBZUHESW-UHFFFAOYSA-N	351.294	0.977	5	40	FCBB	
NC(=O)CC[C@@H](NS(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)O	13097439	TVEKPBCJOOOGMV-MRVPVSSYSA-N	365.751	0.245	5	40	FCBB	
C[C@H]1C[C@@H](C)CN(c2nc(NCCOCCO)nc(N)c2[N+](=O)[O-])C1	13768482	VKSAWWBQJJTCGW-PHIMTYICSA-N	354.411	0.870	5	40	FCBB	
CCn1nnc(NC(=S)NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)n1	32126388	AXTBIZWNJHVYGG-UHFFFAOYSA-N	351.348	0.737	5	40	FCBB	
COC(=O)C1=NN[C@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@@H]12	4940234	CPYTXQKVQAIXMP-RKDXNWHRSA-N	352.690	0.238	5	40	FCBB	
Cc1nnc2n(c1=O)[C@@H](CS(=O)(=O)c1ccc([N+](=O)[O-])cc1)CS2	10034870	KGWMJPSAUOEZSB-SNVBAGLBSA-N	368.396	0.976	5	40	FCBB	
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1	14251205	SYZUQCBISIMLDP-UHFFFAOYSA-N	352.347	0.976	5	40	FCBB	
COc1ccc(C(=O)N2CCN(S(=O)(=O)N(C)C)CC2)cc1[N+](=O)[O-]	25206551	WRSMTZBAKMXONG-UHFFFAOYSA-N	372.403	0.168	5	40	FCBB	
Cc1cc([N+](=O)[O-])c(NC[C@@H](O)[C@H](O)[C@H](O)CO)cc1Br	4774484	LSZRKFXYHZKZCR-UTUOFQBUSA-N	365.180	0.153	5	40	FCBB	
Cc1c(C2=NO[C@H]3C(=O)N(c4cccc([N+](=O)[O-])c4)C(=O)[C@@H]23)cnn1C	101492406	KMIAUIQYGONVBM-GXTWGEPZSA-N	355.310	0.929	5	40	FCBB	
O=c1[nH]c(/C=C/c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)c([N+](=O)[O-])c(=O)[nH]1	105433610	DLGDSYKXOPUFPP-OWOJBTEDSA-N	365.214	0.664	5	40	FCBB	
CCOC(=O)[C@H]1Cc2c([nH]c(=O)[nH]c2=O)O[C@H]1c1ccc([N+](=O)[O-])cc1	1575184	FQCZDYNWLAHGCW-JQWIXIFHSA-N	361.310	0.827	5	40	FCBB	
NC(=O)c1cc([N+](=O)[O-])cnc1N1CCN(C(=O)c2ccncc2)CC1	95449298	NDIGHURDCRRKTI-UHFFFAOYSA-N	356.342	0.446	5	40	FCBB	
O=C(NCCN1CCOCC1)C1CCN(c2ncccc2[N+](=O)[O-])CC1	29525883	XELMITHPXRFVFD-UHFFFAOYSA-N	363.418	0.655	5	40	FCBB	
C[C@@H]1CN(c2nc(N)c([N+](=O)[O-])c(N3CCN(C)CC3)n2)C[C@@H](C)O1	5111911	VSVLOVLJQPPIQS-GHMZBOCLSA-N	351.411	0.332	5	40	FCBB	
CN1N=C(c2ccc([N+](=O)[O-])cc2)Cn2c1nc1c2c(=O)n(C)c(=O)n1C	8926282	DWNGGVSVLKRWIR-UHFFFAOYSA-N	369.341	0.196	5	40	FCBB	
COC(=O)c1c([N+](=O)[O-])ncn1[C@H]1C[C@H](OC(C)=O)[C@H](COC(C)=O)O1	4963340	NWWXMPJWFOFGCK-GARJFASQSA-N	371.302	0.360	5	40	FCBB	
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCCc1ccc2c(c1)OCCO2	14076710	RAFGBXDOCRBTIN-UHFFFAOYSA-N	359.338	0.887	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@H]2C(=O)N(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]12	101001293	CQOUUWHVVWVIEL-MWLCHTKSSA-N	361.270	0.369	5	40	FCBB	
COC(=O)c1c([N+](=O)[O-])ncn1[C@H]1C[C@H](OC(C)=O)[C@@H](COC(C)=O)O1	1719521	NWWXMPJWFOFGCK-HBNTYKKESA-N	371.302	0.360	5	40	FCBB	
Nc1cccc(S(=O)(=O)N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	5616303	XJFZMYQMBQILKK-HUUCEWRRSA-N	367.383	0.550	5	40	FCBB	
COc1cc(N(C)C)c([N+](=O)[O-])cc1C(=O)N1CCN(CCO)CC1	22001653	LUKYWGJOGVCMDG-UHFFFAOYSA-N	352.391	0.420	5	40	FCBB	
CCN1CCN(c2nc(N3C[C@@H](C)O[C@H](C)C3)nc(N)c2[N+](=O)[O-])CC1	5031038	YPRITOSBRGJKRZ-VXGBXAGGSA-N	365.438	0.723	5	40	FCBB	
CC(C)[N+]12CC=C3COC(=O)[C@@](C)(O)[C@@](C)(O)[C@H](C)C(=O)O[C@@H](CC1)[C@@H]32	5208233	LZLZAYWNAJHXBF-VRCASFFDSA-N	368.450	0.531	5	40	FCBB	
COC(=O)[C@@H]1C(=O)C[C@@](C)(O)[C@@H](C(=O)OC)[C@H]1c1ccc([N+](=O)[O-])cc1	3903520	WGWCVBPRRCTFRR-ZOMKSWQUSA-N	365.338	0.981	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(N)cc(=O)[nH]1	15879513	CLYPRQBFDQZTAE-UHFFFAOYSA-N	351.344	1.000	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1N1C(=O)[C@H]2[C@H](C1=O)[C@@]1(CO)C=C[C@@]2(C)O1	100377197	RJWYYAXLVRFRJK-KFZJALRRSA-N	360.322	0.799	5	40	FCBB	
NC(=O)Cn1c(CO)cnc1SCC(=O)Nc1cccc([N+](=O)[O-])c1	10063564	YHUQRVVTAOOTDU-UHFFFAOYSA-N	365.371	0.500	5	40	FCBB	
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCCO)NCC(F)(F)F	6465295	AYYHIOARFHWSLR-UHFFFAOYSA-N	365.264	0.834	5	40	FCBB	
O=C(CN1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1)N1CCOCC1	25372845	ODNWRLYFJHKTIQ-UHFFFAOYSA-N	352.366	0.715	5	40	FCBB	
Cn1ncc(I)c1C(=O)Nn1cc([N+](=O)[O-])cn1	6790379	PFOOEEGFLDETJV-UHFFFAOYSA-N	362.087	0.513	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H]1SC[C@H](C(=O)O)NC1=O	3322350	GRJRUBAQGHMNCR-MWLCHTKSSA-N	369.355	0.617	5	40	FCBB	
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NCc1nnc2ccccn12	12622048	DDCNLQLFRMKQDH-UHFFFAOYSA-N	354.326	0.684	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@H]2CCCC[C@@H]2C(N)=O)c([N+](=O)[O-])c1	83882443	STNDHCUULBGWPM-QWRGUYRKSA-N	356.404	0.959	5	40	FCBB	
Cc1nn(CC(=O)Nn2c(S)nc3ccccc3c2=O)cc1[N+](=O)[O-]	102002414	HFVWNHHRAAOULJ-UHFFFAOYSA-N	360.355	0.869	5	40	FCBB	
CCN1C(=O)NC(=O)[C@@]2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@@H]32)C1=O	13549758	FDRQYFWLVXZCSM-DYVFJYSZSA-N	374.353	0.441	5	40	FCBB	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NC[C@H]2CCS(=O)(=O)C2)c1C	44789945	BHQBSFFRMLVIPR-LLVKDONJSA-N	362.429	0.925	5	40	FCBB	
COc1cc(O)c([C@@H](CO)[C@@H](O)CO)c2oc3cccc(O)c3c(=O)c12	14694894	WHNAJPFARNBVDZ-KWQFWETISA-N	362.334	0.795	5	40	FCBB	biogenic,in-vitro
Cn1c(=O)c2c(ncn2CC(=O)OCc2cccc([N+](=O)[O-])c2)n(C)c1=O	9128483	QEFCAMLTMNMINL-UHFFFAOYSA-N	373.325	0.085	5	40	FCBB	
O=C(NCCN1CCOCC1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	33002200	NDLOAATXZRZZKF-UHFFFAOYSA-N	364.402	0.493	5	40	FCBB	
Cc1nn(CN2CCC(NC(=O)c3cnn(C)c3)CC2)c(C)c1[N+](=O)[O-]	54520637	SOUPGIDHGYZUTB-UHFFFAOYSA-N	361.406	0.994	5	40	FCBB	
Cc1cc2nc3c(=O)n(C)c(=O)n(C)c3nc2cc1NC(=O)CCC(=O)O	4898412	PZPKLHYADQGNNZ-UHFFFAOYSA-N	371.353	0.292	5	40	FCBB	
COc1ccc(NC(=O)C[C@@H]2SC[C@H](C(=O)O)NC2=O)c([N+](=O)[O-])c1	15910127	BEJHFWGJGMABNV-KOLCDFICSA-N	369.355	0.617	5	40	FCBB	
Cc1cccc2c(=O)[nH]c(Cn3cc([N+](=O)[O-])cc(C(N)=O)c3=O)nc12	31812308	QGKVMRJMQVDRIJ-UHFFFAOYSA-N	355.310	0.449	5	40	FCBB	
CN1C(=O)N(C)C(=O)C2(Cc3cc([N+](=O)[O-])ccc3N3CCOC[C@@H]32)C1=O	5354954	VEAKSLKXRROIST-CYBMUJFWSA-N	374.353	0.393	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1NC(=O)CN1CC(OCC(=O)N(C)C)C1	75093978	VTKTUQGZZXYHRA-UHFFFAOYSA-N	366.374	0.331	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1N(CC(=O)NCCN(C)C)S(C)(=O)=O	10111664	HHLZAGWOEDWLPY-UHFFFAOYSA-N	358.420	0.347	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)CC(=O)N1CCC(O)CC1	95461826	QZNBOAWTINKFEZ-UHFFFAOYSA-N	371.415	0.507	5	40	FCBB	
COC(=O)CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1	97165709	LYPQUPGQVBGWBD-UHFFFAOYSA-N	350.375	0.592	5	40	FCBB	
COCCn1ccc2nc3ccn(-c4nc(C)n[nH]4)c(=O)c3cc2c1=O	40285420	PGGGYNDBGKSFIN-UHFFFAOYSA-N	352.354	0.774	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@@H](C(C)(C)C(=O)O)C2)n1	600657015	HIUSWBNDSJBIIO-SECBINFHSA-N	360.392	0.840	5	40	FCBB	
O=C(CCn1cnc([N+](=O)[O-])n1)N1N=C(C(F)F)C[C@@]1(O)C(F)F	6830014	DESNIJCSKKQBAH-SNVBAGLBSA-N	354.220	0.384	5	40	FCBB	
COC(=O)C1=C(N)Oc2c(oc(CO)cc2=O)[C@H]1c1ccccc1[N+](=O)[O-]	12417466	QVNCBRMSRLGETO-LBPRGKRZSA-N	374.305	0.908	5	40	FCBB	biogenic,in-vitro
Nc1nc(NCCCN2CCOCC2)nc(N2CCCC2)c1[N+](=O)[O-]	20330704	NIONHXIVQJXNBQ-UHFFFAOYSA-N	351.411	0.701	5	40	FCBB	
Cc1nnc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n(N)c1=O	3336827	OEMDLYOZUCOIRP-UHFFFAOYSA-N	351.344	0.728	5	40	FCBB	
CNS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@H]2C(N)=O)c([N+](=O)[O-])c1	83882444	STNDHCUULBGWPM-GHMZBOCLSA-N	356.404	0.959	5	40	FCBB	
CN(C)C(=O)CN1CCCN(S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	24688762	DYPFUIZBZLKUJX-UHFFFAOYSA-N	370.431	0.379	5	40	FCBB	
COCCNC(=O)c1cc2c(=O)n3ccccc3nc2n(CCOC)c1=N	100808789	RNZVHJPEPOSZPF-UHFFFAOYSA-N	371.397	0.151	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCN([C@H](C)CO)CC1	95407696	SHCZFPGBEHKIOQ-CHWSQXEVSA-N	366.418	0.929	5	40	FCBB	
Cc1cc(=O)oc2ccn(CCNC(=O)Cn3cc([N+](=O)[O-])cn3)c(=O)c12	1547204106	CIWJZBNOVWURFV-UHFFFAOYSA-N	373.325	0.184	5	40	FCBB	
CNC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@H](C(=O)NC)[C@@H]1c1cccc([N+](=O)[O-])c1	15081132	FLDMLTBKDNCSFC-WVZRYYJFSA-N	363.370	0.127	5	40	FCBB	
COC(=O)[C@@H](O)CNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	96011335	CWGAWNMDQZFNCV-VIFPVBQESA-N	372.277	0.834	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@H](NCCCO)C(=O)O)c([N+](=O)[O-])c1	4939761	BUOATONODACYQJ-LBPRGKRZSA-N	355.347	0.747	5	40	FCBB	
C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C(=O)N1CCNC1=O	32776164	VOYWGRMZKOMFCN-VIFPVBQESA-N	350.331	0.758	5	40	FCBB	
Cc1n[nH]c(-n2ccc3nc4ccn(-n5cnnc5)c(=O)c4cc3c2=O)n1	40372891	JJZJZTRRPSDYQN-UHFFFAOYSA-N	361.325	0.030	5	40	FCBB	
O=[N+]([O-])c1c(N2CCN(C[C@@H](O)[C@H]3CCCO3)CC2)nc2sccn12	79076701	PAHOSDWXBDWBAH-VXGBXAGGSA-N	367.431	0.966	5	40	FCBB	
CCOC(=O)CSc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)c(=O)n2C	20059032	UEKUAXZACRWXKI-UHFFFAOYSA-N	353.356	0.801	5	40	FCBB	
Cc1nc(N2CCOCC2)nc(OCCN2CCOCC2)c1[N+](=O)[O-]	20133792	OEQKKDRHMMMVQR-UHFFFAOYSA-N	353.379	0.241	5	40	FCBB	
CCn1cc(S(=O)(=O)NCCn2cc(Cl)c([N+](=O)[O-])n2)c(C)n1	36614811	XXZQIYPGZVGETM-UHFFFAOYSA-N	362.799	0.948	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1O[C@@H](C)C(=O)N[C@H]1CCS(=O)(=O)C1	7827724	SWFGWHPBUGHJQI-UWVGGRQHSA-N	358.372	0.674	5	40	FCBB	
Cc1ccc(N2C(=O)C[C@H](N3CCC(C(N)=O)CC3)C2=O)cc1[N+](=O)[O-]	14607393	QXQABHUSWAUMQN-AWEZNQCLSA-N	360.370	0.732	5	40	FCBB	
O=C(O)CCNc1ccc(S(=O)(=O)NCCC(=O)O)cc1[N+](=O)[O-]	35686187	TYVATXLNMUCPGN-UHFFFAOYSA-N	361.332	0.234	5	40	FCBB	
CNC(=O)c1cc2c(=O)n3ccccc3nc2n(C[C@H]2CCCO2)c1=N	100809704	MCKCHLFROXPZDQ-LLVKDONJSA-N	353.382	0.667	5	40	FCBB	
NS(=O)(=O)c1ccc2c(c1)oc(=O)c1cc(S(N)(=O)=O)ccc12	2184288	OLVHZDHRZMECBV-UHFFFAOYSA-N	354.365	0.241	5	40	FCBB	
C/C=C1/C[C@H](C)[C@@](O)(CO)C(=O)OCC2=CC[N+]3([O-])CC[C@@H](OC1=O)[C@@H]23	19799816	IDIMIWQPUHURPV-HINUTUINSA-N	367.398	0.178	5	40	FCBB	
COc1cc([N+](=O)[O-])ccc1NC(=O)Cn1cnc2c(cnn2C)c1=O	9337195	CKKRUEQLRZFTSN-UHFFFAOYSA-N	358.314	0.686	5	40	FCBB	
CN(C)CCCNC(=O)CN(c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	13673705	JUJXIEZMTXMGBG-UHFFFAOYSA-N	358.420	0.429	5	40	FCBB	
O=c1[nH]c(=O)c2ccc3c(=O)n(C[C@@H]4CCCO4)c(=O)c4ccc1c2c43	227116799	DVXWWEAZRKOGMG-VIFPVBQESA-N	350.330	0.771	5	40	FCBB	
Cc1ccc(NC(=O)C[C@H]2SC(NC(=N)N)=NC2=O)cc1[N+](=O)[O-]	20407189	BVXBGMLNCRSVJJ-SECBINFHSA-N	350.360	0.713	5	40	FCBB	
CNC(=O)[C@@H]1C(=O)C[C@](C)(O)[C@@H](C(=O)NC)[C@H]1c1cccc([N+](=O)[O-])c1	36619670	FLDMLTBKDNCSFC-CFAJVAMVSA-N	363.370	0.127	5	40	FCBB	
O=C(N[C@@H]1CCS(=O)(=O)C1)[C@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	20648461	HBODRRYPWDHOND-NWDGAFQWSA-N	368.415	0.510	5	40	FCBB	
Nc1ccccc1C1=NC(=O)[C@@]2(CC(c3cccc([N+](=O)[O-])c3)=NN2)NN1	12554448	DRANNCIEFCKUPI-QGZVFWFLSA-N	365.353	0.652	5	40	FCBB	
CN(C)S(=O)(=O)N1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	25206678	BYUIRAYRHKTBRC-UHFFFAOYSA-N	356.404	0.088	5	40	FCBB	
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1CCN([C@@H](C)CO)CC1	95407695	SHCZFPGBEHKIOQ-QWHCGFSZSA-N	366.418	0.929	5	40	FCBB	
COc1cc(OC)c([N+](=O)[O-])cc1/C=C1/NC(=O)N(CC(=O)O)C1=O	408593673	NBNWDIUKCNSAFM-FPYGCLRLSA-N	351.271	0.589	5	40	FCBB	
CCCn1c(=N)c(C(=O)NCCOC)cc2c(=O)n3ccccc3nc21	100913358	LMDBYTXPHMQIQS-UHFFFAOYSA-N	355.398	0.915	5	40	FCBB	
O=[N+]([O-])c1ccc(-n2nc3ccc4c(no[n+]4[O-])c3[n+]2[O-])c([N+](=O)[O-])c1	6001917	SSTNXBWNABSLGO-UHFFFAOYSA-N	359.214	0.250	5	40	FCBB	
CC(=O)COC(=O)CNS(=O)(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1	9219990	IUXGBBPWNJEWEB-UHFFFAOYSA-N	359.360	0.071	5	40	FCBB	
CCn1c(CNC(=O)c2cccc([N+](=O)[O-])c2)nnc1SCC(N)=O	409131791	OXHKXJPXAZZQMH-UHFFFAOYSA-N	364.387	0.714	5	40	FCBB	
NS(=O)(=O)c1ccc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1	23762067	BSGAHOJKGRUGPT-UHFFFAOYSA-N	363.399	0.964	5	40	FCBB	
CCOC(=O)NC(=O)COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	3391423	ZNSLXDDSUFNITI-UHFFFAOYSA-N	353.287	0.141	5	40	FCBB	
NS(=O)(=O)c1cccc(NC(=O)COc2cccnc2[N+](=O)[O-])c1	9714761	ZPKFNIPSRIEIAT-UHFFFAOYSA-N	352.328	0.655	5	40	FCBB	
CN(C)CCNS(=O)(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1	13074142	LNEJXSIHULKALJ-UHFFFAOYSA-N	371.463	0.187	5	40	FCBB	
COC(=O)[C@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1	101509240	WGETYYLVMDBIRH-XJIUQZFPSA-N	365.338	0.981	5	40	FCBB	
C[C@H]1CN(S(=O)(=O)NCCNc2ccccc2[N+](=O)[O-])C[C@H](C)O1	12561498	KAKIVGBSZDHING-RYUDHWBXSA-N	358.420	0.950	5	40	FCBB	
C/C=C1/C[C@H](C)[C@](O)(CO)C(=O)OCC2=CC[N+]3([O-])CC[C@@H](OC1=O)[C@@H]23	19799818	IDIMIWQPUHURPV-OOFASRIMSA-N	367.398	0.178	5	40	FCBB	
CCOC(=O)C1=C(COC(=O)c2ccc([N+](=O)[O-])o2)NC(=O)N[C@H]1C	22860040	VJDZDEKOSOSOFG-ZETCQYMHSA-N	353.287	0.863	5	40	FCBB	
CC(=O)O[C@H]1[C@H](Oc2ccccc2[N+](=O)[O-])OC[C@@H](O)[C@H]1OC(C)=O	22064890	OPXWOTRGXPBRCG-NGFQHRJXSA-N	355.299	0.554	5	40	FCBB	
C[S@@](=O)CCN1CCN(C(=O)COc2ccccc2[N+](=O)[O-])CC1	76020586	MWJOVAOYRLEKQV-DEOSSOPVSA-N	355.416	0.496	5	40	FCBB	
O=C(COc1ccccc1[N+](=O)[O-])NCCCNC(=O)c1cnccn1	9227289	NWXRYTZHEWXEAT-UHFFFAOYSA-N	359.342	0.700	5	40	FCBB	
COc1ccc(C(=O)OCC(=O)N[C@H]2CCS(=O)(=O)C2)cc1[N+](=O)[O-]	9612685	GDCXTLQWNCSESW-JTQLQIEISA-N	372.355	0.064	5	40	FCBB	
CC(=O)O[C@@H]1[C@@H](Oc2ccccc2[N+](=O)[O-])OC[C@H](O)[C@H]1OC(C)=O	584578733	OPXWOTRGXPBRCG-PMOUVXMZSA-N	355.299	0.554	5	40	FCBB	
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1	2805223	RMYZXERTCMAOJO-MFKMUULPSA-N	365.302	0.061	5	40	FCBB	biogenic,in-vitro
O=C(COc1ccc([N+](=O)[O-])cc1)NCCCNC(=O)c1cnccn1	7871487	GNHIVKWZPMYCQT-UHFFFAOYSA-N	359.342	0.700	5	40	FCBB	
C[C@@H](O)CNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	15209571	AFTFFGHVHHUMRJ-LLVKDONJSA-N	358.420	0.324	5	40	FCBB	
CC[C@@H](C)NC(=O)CN1CCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	29531979	VTJHULKJTOSXQX-GFCCVEGCSA-N	363.418	0.730	5	40	FCBB	
CN(C)S(=O)(=O)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	40105811	CIKQQEDZLZNXMV-UHFFFAOYSA-N	358.420	0.398	5	40	FCBB	
CS(=O)(=O)N[C@@H]1CCCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	58081364	PTTRASLLBHXYJH-SNVBAGLBSA-N	370.387	0.474	5	40	FCBB	
CN(C)C(=O)OCC[N+](C)(C)CCC[N+](C)(C)CCOC(=O)N(C)C	5046553	OXFBYUFOFLXWJC-UHFFFAOYSA-N	362.515	0.926	5	40	FCBB	
COC(=O)[C@H]1C(=O)C[C@@](C)(O)[C@H](C(=O)OC)[C@@H]1c1ccc([N+](=O)[O-])cc1	101646589	WGWCVBPRRCTFRR-XJIUQZFPSA-N	365.338	0.981	5	40	FCBB	
C[C@@H](OC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)C(=O)NC1CC1	4538910	YSVZMAGVDHMMHG-MRVPVSSYSA-N	356.356	0.822	5	40	FCBB	
Cn1c(=O)n(C)c2cc([N+](=O)[O-])c(NC(=O)CSc3nc[nH]n3)cc21	408544701	WVAUFKJOSRLUKA-UHFFFAOYSA-N	363.359	0.634	5	40	FCBB	
NC(=O)[C@@H]1CC[C@@H](CNC(=O)CCCNc2ccccc2[N+](=O)[O-])O1	84506984	VPZZTGPJNDAQLQ-FZMZJTMJSA-N	350.375	0.936	5	40	FCBB	
Cn1cnc([N+](=O)[O-])c1N1CCN(S(=O)(=O)c2cccnc2)CC1	32825043	ITKJOQUWMNRRNJ-UHFFFAOYSA-N	352.376	0.234	5	40	FCBB	
CN(C)CCCn1ccc2nc3ccn(-c4ncn[nH]4)c(=O)c3cc2c1=O	40372873	AZZCMHQPSAMSKM-UHFFFAOYSA-N	365.397	0.770	5	40	FCBB	
CC(C)CS(=O)(=O)c1ccc([C@@]2(O)C[N+](C)(CCO)CCO2)cc1	701976	SFJSXWSZLJMWSG-QNSVNVJESA-N	358.480	0.731	5	40	FCBB	
CNC(=O)CN(C)c1ccc(S(=O)(=O)NC(C)(C)C)cc1[N+](=O)[O-]	18057335	FJZBMISYBRNZSN-UHFFFAOYSA-N	358.420	0.854	5	40	FCBB	
C[C@H](C(=O)NC(N)=O)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1	57358639	MVFSAMCPTNEENC-LLVKDONJSA-N	372.385	0.848	5	40	FCBB	
CCOc1ccc(NC(=O)C[C@@H](NC[C@H](C)O)C(=O)O)c([N+](=O)[O-])c1	5258775	XCMOIWYHJHVFFS-JOYOIKCWSA-N	355.347	0.746	5	40	FCBB	
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C(=O)N1CCNC1=O	32776163	VOYWGRMZKOMFCN-SECBINFHSA-N	350.331	0.758	5	40	FCBB	
O=[N+]([O-])c1cnn(CN2CCN(S(=O)(=O)c3cccnc3)CC2)c1	58158682	IWFQHAOYQGDBQT-UHFFFAOYSA-N	352.376	0.150	5	40	FCBB	
Cc1nn(CC(=O)N2CCN(C(=O)c3ccco3)CC2)c(C)c1[N+](=O)[O-]	3337725	KOGVLCRAVXIFDI-UHFFFAOYSA-N	361.358	0.986	5	40	FCBB	
CS(=O)(=O)N1CCN(C(=O)Cn2ccc3c([N+](=O)[O-])cccc32)CC1	96118643	ZHPMNTPZANQGAI-UHFFFAOYSA-N	366.399	0.653	5	40	FCBB	
Cc1cc(-n2cnc3c(N(CCO)CCO)ncnc32)ccc1[N+](=O)[O-]	1657429	VYABGOCAUSAWSN-UHFFFAOYSA-N	358.358	0.823	5	40	FCBB	
CCOC(=O)C1=NN[C@H]2C(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C(=O)[C@H]12	100831112	RKHGLKNDPDRRCI-VHSXEESVSA-N	366.717	0.629	5	40	FCBB	
CCn1c2nc(=O)n(C)c(=O)c-2[n+]([O-])c2cc(Br)c(C)cc21	1859160	WDCMYKRUMXNSJM-UHFFFAOYSA-N	365.187	0.924	5	40	FCBB	
Cn1c(=O)c2c(nc3n2CC(c2ccc([N+](=O)[O-])cc2)=NN3)n(C)c1=O	9042717	VVNCUEGSNFGRBO-UHFFFAOYSA-N	355.314	0.172	5	40	FCBB	
CC1=C(C(N)=O)[C@H](c2ccccc2[N+](=O)[O-])N2NC(CCCO)=NC2=N1	4294223	QQWLEAMMMVCYAR-AWEZNQCLSA-N	358.358	0.756	5	40	FCBB	
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCN(S(C)(=O)=O)CC1	15400763	ITTURPCHTNTXNB-LLVKDONJSA-N	356.404	0.499	5	40	FCBB	
C[C@@]1(NC(=O)COC(=O)Cc2ccccc2[N+](=O)[O-])CCS(=O)(=O)C1	24461451	VSIFVFUXYZUZAM-OAHLLOKOSA-N	370.383	0.374	5	40	FCBB	
Cn1cc([N+](=O)[O-])c(S(=O)(=O)N2CCC[C@H](C(C)(C)C(=O)O)C2)n1	600657020	HIUSWBNDSJBIIO-VIFPVBQESA-N	360.392	0.840	5	40	FCBB	
Cc1c(Br)cnn1CC(=O)NCCn1cc([N+](=O)[O-])cn1	2781741	HVHDNSSTVDTIKK-UHFFFAOYSA-N	357.168	0.875	5	40	FCBB	
CCOC(=O)C1=NN(N=O)[C@H]2C(=O)N(c3cccc([N+](=O)[O-])c3)C(=O)[C@@H]12	9330129	JNVZXBRAGGTWLW-GXSJLCMTSA-N	361.270	0.369	5	40	FCBB	
CCOCCCn1c(=N)c(C(=O)NC)cc2c(=O)n3ccccc3nc21	100628051	PJJRZBDSWBUQMD-UHFFFAOYSA-N	355.398	0.915	5	40	FCBB	
COCCNc1ccc(S(=O)(=O)NCCCN(C)C)cc1[N+](=O)[O-]	6831107	VHACOFUIQSOSBT-UHFFFAOYSA-N	360.436	0.883	5	40	FCBB	
CS(=O)(=O)N1CCN(C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)CC1	17815609	SMXITCIVSZSCIW-UHFFFAOYSA-N	368.415	0.887	5	40	FCBB	
Cc1ccc(OCC(=O)Nc2cccc(S(N)(=O)=O)c2)c([N+](=O)[O-])n1	33576079	ZOVAADCIYYLNDM-UHFFFAOYSA-N	366.355	0.963	5	40	FCBB	
Cc1ccc(CN(C)C(=O)Cn2cc([N+](=O)[O-])cc(C(N)=O)c2=O)cc1	40050070	WWQSCTFPZXRTCF-UHFFFAOYSA-N	358.354	0.822	5	40	FCBB	
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NCCCNS(C)(=O)=O)c1C	12982355	NULFZXMJOLSYKR-UHFFFAOYSA-N	365.433	0.429	5	40	FCBB	
COc1cc(C(=O)OCC(=O)N2CCCC2=O)c([N+](=O)[O-])cc1OC	3518211	NYQGODNWUKYLJV-UHFFFAOYSA-N	352.299	0.918	5	40	FCBB	
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCNS(C)(=O)=O	12936941	ZQJGFPIYWNYKFM-UHFFFAOYSA-N	351.406	0.121	5	40	FCBB	
COc1ccc(S(=O)(=O)N2CCCN(C(C)=O)CC2)cc1[N+](=O)[O-]	24710540	QHAUXZAZAUYJII-UHFFFAOYSA-N	357.388	0.846	5	40	FCBB	
CCN1CCN(c2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)O[C@H](C)C3)n2)CC1	5217002	NBWYJFRXOSUWEP-TXEJJXNPSA-N	365.438	0.723	5	40	FCBB	
O=C(COC(=O)/C=C/c1ccccc1[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1	6473539	BVLZUPUTDINQBI-FYJFLYSWSA-N	368.367	0.455	5	40	FCBB	
O=[N+]([O-])c1c(N2CCN(C[C@H](O)[C@H]3CCCO3)CC2)nc2sccn12	79076694	PAHOSDWXBDWBAH-NWDGAFQWSA-N	367.431	0.966	5	40	FCBB	
COc1ccc(S(=O)(=O)N2C[C@@H](C(N)=O)CC[C@H]2C)c([N+](=O)[O-])c1	40135552	YPVPMMJHXDMEND-ZJUUUORDSA-N	357.388	0.878	5	40	FCBB	
O=C1[C@@H]2[C@@H](C(=O)N1[C@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1C=C[C@H]2C1	101678811	LBCYYMHCYKZZAX-GEZJYSALSA-N	358.350	0.796	5	40	FCBB	
O=C1NCCN1CCN1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	58297878	BYQMWIOKALPZKW-UHFFFAOYSA-N	364.362	0.650	5	40	FCBB	
Cc1ccc(OCC(=O)Nc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])n1	6094675	ZIEQDFOFDOXKKO-UHFFFAOYSA-N	366.355	0.963	5	40	FCBB	
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H](CO)[C@@H](O)c1ccc([N+](=O)[O-])cc1	2805222	RMYZXERTCMAOJO-GWCFXTLKSA-N	365.302	0.061	5	40	FCBB	biogenic,in-vitro
CS(=O)(=O)N1CCN(CCC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	26338196	GQHDRFKHRKHCLV-UHFFFAOYSA-N	356.404	0.501	5	40	FCBB