pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.7	OCHEM	0	-1	CCCCCCCCCCCCCCCCSC[C@H](O)[C@@H]1OC(=O)C(O)=C1OC	CCCCCCCCCCCCCCCCSC[C@H](O)[C@@H]1OC(=O)C([O-])=C1OC	mol32241	CCCCCCCCCCCCCCCCSCC(O)C1OC(=O)C(O)=C1OC