Glycoside
GD012449
Name:
(E)-Resveratrol 3-(4''-Acetyll)-O-Beta-D-XylopyranosideFormula:
C21H22O8Smiles:
CC(=O)O[C@@H]1CO[C@H](Oc2cc(O)cc(C=Cc3ccc(O)cc3)c2)[C@H](O)[C@H]1OAglycone:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1Sugarmoiety:
CC(=O)OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | 1.66 | Num_rotatable_bonds: | 5 |
| MolWt: | 402.4 | Num_heavy_atoms: | 29 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD01773
Formula: C14H12O3
Smiles:
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 228.25 | Num_heavy_atoms: | 17 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
