Molecule ID: mol32046
SMILES: C/N=C(\C[N+](=O)[O-])N/N=C/[C@H]1CC[C@]2(O)[C@@H]3CC[C@@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChI: InChI=1S/C23H38N4O4/c1-21-9-7-17(28)12-15(21)4-5-19-18(21)8-10-22(2)16(6-11-23(19,22)29)13-25-26-20(24-3)14-27(30)31/h13,15-19,28-29H,4-12,14H2,1-3H3,(H,24,26)/b25-13+/t15-,16-,17+,18+,19-,21+,22-,23+/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.37 | OCHEM | 2 » 1 |