Glycoside
GD007661
Name:
4'-O-Beta-D-Glucopyranosyl-4-Hydroxy-3'-MethoxychalconeFormula:
C22H24O9Smiles:
COc1cc(C(=O)C=Cc2ccc(O)cc2)ccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(C(=O)C=Cc2ccc(O)cc2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD06210
Formula: C16H14O4
Smiles:
COc1cc(C(=O)C=Cc2ccc(O)cc2)ccc1O| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 3.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 270.28 | Num_heavy_atoms: | 20 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
