Molecule ID: mol9596
SMILES: O=CC[C@@H](O)[C@H](O)[C@H](O)CO
InChI: InChI=1S/C6H12O5/c7-2-1-4(9)6(11)5(10)3-8/h2,4-6,8-11H,1,3H2/t4-,5-,6+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.28 | IUPAC digitized pKa | 0 » -1 |
| 12.51 | IUPAC digitized pKa | 0 » -1 |
| 12.52 | IUPAC digitized pKa | 0 » -1 |
| 12.89 | IUPAC digitized pKa | 0 » -1 |