smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)CCc2c(c([O-])cc3oc4cc([O-])c5c(c4c(=O)c32)OC(C)(C)CC5)O1	ZINC000085945801	222325208	/nfs/dbraw/zinc/32/52/08/222325208.db2.gz	NAONXHGSDQDBNY-UHFFFAOYSA-N	-2	3	396.439	4.565	10	5	biogenic,in-vitro	GJBEHL
CC1(C)CCc2c(cc3oc4cc([O-])c5c(c4c([O-])c-3c2=O)CCC(C)(C)O5)O1	ZINC000014766825	221318134	/nfs/dbraw/zinc/31/81/34/221318134.db2.gz	QFURCBFEIGTKCW-UHFFFAOYSA-N	-2	3	396.439	4.565	10	5	endogenous,in-man	GJBEHL