Glycoside
GD058167
Name:
NoneFormula:
C11H14O9N4Smiles:
O=[N+]([O-])c1cnc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c([N+](=O)[O-])c1Aglycone:
Nc1ncc([N+](=O)[O-])cc1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 346.25 | Num_heavy_atoms: | 24 |
| TPSA: | 201.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD29122
Formula: C5H4O4N4
Smiles:
Nc1ncc([N+](=O)[O-])cc1[N+](=O)[O-]| HBA: | 8 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 184.11 | Num_heavy_atoms: | 13 |
| TPSA: | 125.19 | NumAromaticRings: | 1 |
