Glycoside
GD025465
Name:
NoneFormula:
C14H16O7N4Smiles:
O=[N+]([O-])c1ccc(-c2n[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)n2)cc1Aglycone:
O=[N+]([O-])c1ccc(-c2nc[nH]n2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 352.3 | Num_heavy_atoms: | 25 |
| TPSA: | 174.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD16879
Formula: C8H6O2N4
Smiles:
O=[N+]([O-])c1ccc(-c2nc[nH]n2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 2 |
| MolWt: | 190.16 | Num_heavy_atoms: | 14 |
| TPSA: | 84.71 | NumAromaticRings: | 2 |
