Molecule ID: mol37302

SMILES: O=C(O)CCCNC[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O

InChI: InChI=1S/C10H19NO7/c12-6-4-18-10(17,9(16)8(6)15)5-11-3-1-2-7(13)14/h6,8-9,11-12,15-17H,1-5H2,(H,13,14)/t6-,8-,9+,10-/m1/s1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.93 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization