pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
2.35	Datawarrior	0	-1	CC(C)=CC[C@@H]1C(=O)C(C(=O)CC(C)C)=C(O)[C@H]1O	CC(C)=CC[C@@H]1C(=O)C(C(=O)CC(C)C)=C([O-])[C@H]1O	mol15568	CC(C)=CC[C@@H]1C(=O)C(C(=O)CC(C)C)=C(O)[C@H]1O