pka_value	data_source	charge_state_pre	charge_state_post	microspecies_pre	microspecies_post	molid	smiles
9.36	OCHEM	1	0	C[C@H]1C[C@H](O[N+](=O)[O-])[C@@H]2CCCC[C@H]2[NH2+]1	C[C@H]1C[C@H](O[N+](=O)[O-])[C@@H]2CCCC[C@H]2N1	mol1638	C[C@H]1C[C@H](O[N+](=O)[O-])[C@@H]2CCCC[C@H]2N1