smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC(=O)c1c(O)c(C)c(OC)c(CC2C(=O)C(C(=O)CCC)=C([O-])C(C)(C)C2=O)c1O	ZINC000002040085	560186138	/nfs/dbraw/zinc/18/61/38/560186138.db2.gz	CMKHZPXDAXVNES-UHFFFAOYSA-N	-1	2	460.523	4.542	10	30	biogenic,in-vitro	JJEELM
CCCC(=O)c1c(O)c(C)c(OC)c(CC2C(=O)C(C)(C)C(=O)C(C(=O)CCC)=C2[O-])c1O	ZINC000002040085	560186139	/nfs/dbraw/zinc/18/61/39/560186139.db2.gz	CMKHZPXDAXVNES-UHFFFAOYSA-N	-1	2	460.523	4.542	10	30	biogenic,in-vitro	JJEELM