Glycoside
GD016269
Name:
NoneFormula:
C11H13O6N5Smiles:
Nc1cc([N+](=O)[O-])nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1cc([N+](=O)[O-])nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.25 | Num_heavy_atoms: | 22 |
| TPSA: | 169.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD11741
Formula: C6H4O2N5
Smiles:
Nc1cc([N+](=O)[O-])nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 1 |
| MolWt: | 178.13 | Num_heavy_atoms: | 13 |
| TPSA: | 108.51 | NumAromaticRings: | 1 |
