Glycoside
GD133370
Name:
4-[(3,4-dimethoxyphenyl)methyl]-3-[(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methylidene]oxolan-2-oneFormula:
C27H32O11Smiles:
COc1ccc(CC2COC(=O)C2=Cc2ccc(OC3OC(CO)C(O)C(O)C3O)c(OC)c2)cc1OCAglycone:
COc1cc(C=C2C(=O)OCC2Cc2ccc(OC)c(OC)c2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 9 |
| MolWt: | 532.54 | Num_heavy_atoms: | 38 |
| TPSA: | 153.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD53985
Formula: C21H22O6
Smiles:
COc1cc(C=C2C(=O)OCC2Cc2ccc(OC)c(OC)c2)ccc1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 3.22 | Num_rotatable_bonds: | 6 |
| MolWt: | 370.4 | Num_heavy_atoms: | 27 |
| TPSA: | 74.22 | NumAromaticRings: | 2 |
