Glycoside
GD010500
Name:
NoneFormula:
C9H13O6N5Smiles:
Nc1ncnc(N[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c1[N+](=O)[O-]Aglycone:
Nc1ncnc(N)c1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -2.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 287.23 | Num_heavy_atoms: | 20 |
| TPSA: | 176.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD08101
Formula: C4H5O2N5
Smiles:
Nc1ncnc(N)c1[N+](=O)[O-]| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 1 |
| MolWt: | 155.12 | Num_heavy_atoms: | 11 |
| TPSA: | 120.96 | NumAromaticRings: | 1 |
