Glycoside
GD031069
Name:
NoneFormula:
C13H17O8NSmiles:
Nc1ccc(C(=O)O)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
Nc1ccc(C(=O)O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 162.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD20049
Formula: C7H7O3N
Smiles:
Nc1ccc(C(=O)O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 153.14 | Num_heavy_atoms: | 11 |
| TPSA: | 83.55 | NumAromaticRings: | 1 |
