Molecule ID: mol36353
SMILES: O=C(O)[C@H]1OCCOCCO[C@H](C(=O)O)[C@H](C(=O)O)OCCOCCO[C@H]1C(=O)O
InChI: InChI=1S/C16H24O14/c17-13(18)9-10(14(19)20)29-7-3-26-4-8-30-12(16(23)24)11(15(21)22)28-6-2-25-1-5-27-9/h9-12H,1-8H2,(H,17,18)(H,19,20)(H,21,22)(H,23,24)/t9-,10+,11-,12+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.94 | QSARToolbox | -2 » -3 |