Molecule ID: mol33458
SMILES: O=C([O-])C[N+](CCC(=O)O)CC[N+](CCC(=O)O)CC(=O)[O-]
InChI: InChI=1S/C12H20N2O8/c15-9(16)1-3-13(7-11(19)20)5-6-14(8-12(21)22)4-2-10(17)18/h1-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)/q+2/p-2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.30 | OCHEM | 0 » -1 |
| 3.50 | OCHEM | 0 » -1 |