smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1cccc2c(=O)c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc([O-])c(OC)c3oc12	ZINC000033830760	560088615	/nfs/dbraw/zinc/08/86/15/560088615.db2.gz	HRCCENSJCLPPIM-VBLNFAOOSA-N	-1	3	450.396	-0.152	1	5	biogenic,in-vitro	JBBFHM
COc1cccc2c(=O)c3c([O-])cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c3oc12	ZINC000033830761	560088586	/nfs/dbraw/zinc/08/85/86/560088586.db2.gz	XLMSZNWYLZCTEQ-VBLNFAOOSA-N	-1	3	450.396	-0.152	1	5	biogenic,in-vitro	JBBFHM
COc1cccc2c([O-])c3c(=O)cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(OC)c-3oc12	ZINC000033830761	560088584	/nfs/dbraw/zinc/08/85/84/560088584.db2.gz	XLMSZNWYLZCTEQ-VBLNFAOOSA-N	-1	3	450.396	-0.152	1	5	biogenic,in-vitro	JBBFHM
COc1cc([O-])c2c(=O)c3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3oc2c1OC	ZINC000040878343	563152632	/nfs/dbraw/zinc/15/26/32/563152632.db2.gz	AVZPRERNBNKYMD-GUFUGUNKSA-N	-1	3	450.396	-0.152	1	5		JBBFHM
COc1cc(=O)c2c([O-])c3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3oc-2c1OC	ZINC000040878343	563152630	/nfs/dbraw/zinc/15/26/30/563152630.db2.gz	AVZPRERNBNKYMD-GUFUGUNKSA-N	-1	3	450.396	-0.152	1	5		JBBFHM
COc1cccc2c(=O)c3c(O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc([O-])c(OC)c3oc12	ZINC000070454543	560048178	/nfs/dbraw/zinc/04/81/78/560048178.db2.gz	HRCCENSJCLPPIM-LGLXUDKQSA-N	-1	3	450.396	-0.152	1	5	biogenic,in-vitro	JBBFHM