Glycoside
GD009008
Name:
NoneFormula:
C15H17O6N5Smiles:
O=[N+]([O-])c1c(Nc2ccccc2)ncnc1N[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc(Nc2ccccc2)c1[N+](=O)[O-]Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 363.33 | Num_heavy_atoms: | 26 |
| TPSA: | 162.9 | NumAromaticRings: | 2 |
Unique Aglycone
AD07118
Formula: C10H9O2N5
Smiles:
Nc1ncnc(Nc2ccccc2)c1[N+](=O)[O-]| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 231.22 | Num_heavy_atoms: | 17 |
| TPSA: | 106.97 | NumAromaticRings: | 2 |
