Molecule ID: mol7402
SMILES: CN(C)c1ncc([N+](=O)[O-])c(NC2(O)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)n1
InChI: InChI=1S/C12H19N5O8/c1-16(2)11-13-3-5(17(23)24)10(14-11)15-12(22)9(21)8(20)7(19)6(4-18)25-12/h3,6-9,18-22H,4H2,1-2H3,(H,13,14,15)/t6-,7-,8+,9-,12?/m1/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.27 | IUPAC digitized pKa | 1 » 0 |