Molecule ID: mol37320

SMILES: O=P(O)(O)OC1[C@H](O)[C@@H](OP(=O)(O)O)[C@H](OP(=O)(O)O)[C@H]1O

InChI: InChI=1S/C5H13O14P3/c6-1-3(17-20(8,9)10)2(7)5(19-22(14,15)16)4(1)18-21(11,12)13/h1-7H,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)/t1-,2-,4+,5+/m0/s1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.21 QSARToolbox -5 » -6
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization