Glycoside
GD138848
Name:
4,2'-Dihydroxy-4',6'-Dimethoxychalcone 4-Apiosyl-(1->2)-GlucosideFormula:
C28H34O14Smiles:
COc1cc(O)c(C(=O)C=Cc2ccc(OC3OC(CO)C(O)C(O)C3OC3OCC(O)(CO)C3O)cc2)c(OC)c1Aglycone:
COc1cc(O)c(C(=O)C=Cc2ccc(O)cc2)c(OC)c1Sugarmoiety:
OCC1OC(O)C(OC2OCC(O)(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.46 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 11 |
| MolWt: | 594.57 | Num_heavy_atoms: | 42 |
| TPSA: | 214.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD49148
Formula: C17H16O5
Smiles:
COc1cc(O)c(C(=O)C=Cc2ccc(O)cc2)c(OC)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 3.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 300.31 | Num_heavy_atoms: | 22 |
| TPSA: | 75.99 | NumAromaticRings: | 2 |
