pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
6.91	Datawarrior	1	0	CC[NH+](C[C@H]1CO1)C[C@H]1CO1	CCN(C[C@H]1CO1)C[C@H]1CO1	mol14009	CCN(CC1CO1)CC1CO1
6.9099998	OCHEM	1	0	CC[NH+](C[C@H]1CO1)C[C@H]1CO1	CCN(C[C@H]1CO1)C[C@H]1CO1	mol14009	CCN(CC1CO1)CC1CO1