Glycoside
GD069752
Name:
NoneFormula:
C15H20O8N2Smiles:
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1OCc1ccc([N+](=O)[O-])cc1Aglycone:
O=[N+]([O-])c1ccc(CO)cc1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.33 | Num_heavy_atoms: | 25 |
| TPSA: | 151.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD25354
Formula: C7H7O3N
Smiles:
O=[N+]([O-])c1ccc(CO)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.09 | Num_rotatable_bonds: | 2 |
| MolWt: | 153.14 | Num_heavy_atoms: | 11 |
| TPSA: | 63.37 | NumAromaticRings: | 1 |
