Glycoside
GD078774
Name:
NoneFormula:
C18H20O8N2Smiles:
O=[N+]([O-])c1ccc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cc1Aglycone:
O=[N+]([O-])c1ccc(Nc2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.36 | Num_heavy_atoms: | 28 |
| TPSA: | 154.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD36205
Formula: C12H10O3N2
Smiles:
O=[N+]([O-])c1ccc(Nc2ccc(O)cc2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 230.22 | Num_heavy_atoms: | 17 |
| TPSA: | 75.4 | NumAromaticRings: | 2 |
