Glycoside
GD036771
Name:
NoneFormula:
C24H35O16NSmiles:
C[C@H](O)[C@@H]1O[C@H](O[C@@H]2[C@H](Oc3ccc([N+](=O)[O-])cc3)O[C@H]([C@H](O)CO)[C@H]2O)[C@H](O[C@@H]2O[C@H]([C@H](C)O)[C@H](O)[C@H]2O)[C@H]1OAglycone:
O=[N+]([O-])c1ccc(O)cc1Sugarmoiety:
CC(O)C1OC(OC2C(OC3C(O)OC(C(O)CO)C3O)OC(C(C)O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.75 |
| AlogP: | -3.52 | Num_rotatable_bonds: | 11 |
| MolWt: | 593.54 | Num_heavy_atoms: | 41 |
| TPSA: | 260.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD00091
Formula: C6H5O3N
Smiles:
O=[N+]([O-])c1ccc(O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 139.11 | Num_heavy_atoms: | 10 |
| TPSA: | 63.37 | NumAromaticRings: | 1 |
