Glycoside
GD030063
Name:
NoneFormula:
C20H21O9N3Smiles:
O=C(NN=Cc1cccc([N+](=O)[O-])c1)c1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
O=C(NN=Cc1cccc([N+](=O)[O-])c1)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 7 |
| MolWt: | 447.4 | Num_heavy_atoms: | 32 |
| TPSA: | 183.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD19476
Formula: C14H11O4N3
Smiles:
O=C(NN=Cc1cccc([N+](=O)[O-])c1)c1ccc(O)cc1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 4 |
| MolWt: | 285.26 | Num_heavy_atoms: | 21 |
| TPSA: | 104.83 | NumAromaticRings: | 2 |
