Glycoside
GD007774
Name:
NoneFormula:
C21H24O8Smiles:
CC(C(=O)O)c1cccc(-c2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
CC(C(=O)O)c1cccc(-c2ccccc2O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.42 | Num_heavy_atoms: | 29 |
| TPSA: | 136.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD06296
Formula: C15H14O3
Smiles:
CC(C(=O)O)c1cccc(-c2ccccc2O)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 3.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 242.27 | Num_heavy_atoms: | 18 |
| TPSA: | 57.53 | NumAromaticRings: | 2 |
