Glycoside
GD034111
Name:
NoneFormula:
C13H17O8NSmiles:
Cc1cc([N+](=O)[O-])ccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cc1cc([N+](=O)[O-])ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.54 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 142.52 | NumAromaticRings: | 1 |
Unique Aglycone
AD21718
Formula: C7H7O3N
Smiles:
Cc1cc([N+](=O)[O-])ccc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.61 | Num_rotatable_bonds: | 1 |
| MolWt: | 153.14 | Num_heavy_atoms: | 11 |
| TPSA: | 63.37 | NumAromaticRings: | 1 |
