Molecule ID: mol37342
SMILES: O=P(O)(O)O[C@@H]1[C@H](OP(=O)(O)O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1OP(=O)(O)O
InChI: InChI=1S/C6H15O15P3/c7-1-2(8)4(19-22(10,11)12)6(21-24(16,17)18)5(3(1)9)20-23(13,14)15/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)/t1-,2-,3+,4-,5-,6-/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.61 | QSARToolbox | -3 » -4 |
| 7.08 | QSARToolbox | -5 » -6 |