Glycoside
GD023014
Name:
NoneFormula:
C13H16O9N2Smiles:
O=[N+]([O-])c1ccc(O)c(C=NO[C@@H]2OC(CO)C(O)[C@H](O)C2O)c1Aglycone:
O=[N+]([O-])c1ccc(O)c(C=NO)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -1.55 | Num_rotatable_bonds: | 5 |
| MolWt: | 344.28 | Num_heavy_atoms: | 24 |
| TPSA: | 175.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD15527
Formula: C7H6O4N2
Smiles:
O=[N+]([O-])c1ccc(O)c(C=NO)c1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 2 |
| MolWt: | 182.13 | Num_heavy_atoms: | 13 |
| TPSA: | 95.96 | NumAromaticRings: | 1 |
