Molecule ID: mol31222
SMILES: O=C1C(O)=C(O)C(=O)C(O)(O)C1(O)O
InChI: InChI=1S/C6H6O8/c7-1-2(8)4(10)6(13,14)5(11,12)3(1)9/h7-8,11-14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.25 | AttenGpKa training set | 0 » -1 |
| 4.72 | AttenGpKa training set | 0 » -1 |