pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
7.1	IUPAC digitized pKa	1	0	CO[C@@H]1[C@@H]([NH3+])[C@H](O)O[C@H](CO)[C@H]1O	CO[C@@H]1[C@@H](N)[C@H](O)O[C@H](CO)[C@H]1O	mol8628	CO[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1N
7.09999990463257	QSARToolbox	1	0	CO[C@@H]1[C@@H]([NH3+])[C@H](O)O[C@H](CO)[C@H]1O	CO[C@@H]1[C@@H](N)[C@H](O)O[C@H](CO)[C@H]1O	mol8628	CO[C@H]1[C@H](O)[C@@H](CO)OC(O)[C@@H]1N
