pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
12.6999998092651	QSARToolbox	0	-1	OC[C@H]1O[C@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O	[O-][C@@H]1[C@@H](O)[C@@H](Oc2ccccc2)O[C@H](CO)[C@H]1O,[O-][C@H]1[C@@H](Oc2ccccc2)O[C@H](CO)[C@@H](O)[C@@H]1O,[O-]C[C@H]1O[C@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O,[O-][C@H]1[C@H](O)[C@@H](O)[C@@H](Oc2ccccc2)O[C@@H]1CO	mol36952	OC[C@H]1O[C@H](Oc2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O