Glycoside
GD058214
Name:
NoneFormula:
C13H17O8N2FSmiles:
COc1cc([N+](=O)[O-])c(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1FAglycone:
COc1cc([N+](=O)[O-])c(N)cc1FSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 348.28 | Num_heavy_atoms: | 24 |
| TPSA: | 154.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD29145
Formula: C7H7O3N2F
Smiles:
COc1cc([N+](=O)[O-])c(N)cc1F| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.32 | Num_rotatable_bonds: | 2 |
| MolWt: | 186.14 | Num_heavy_atoms: | 13 |
| TPSA: | 78.39 | NumAromaticRings: | 1 |
