Glycoside
GD124420
Name:
(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]methyl}phenyl)methyl 4-(3,4-dihydroxyphenyl)but-2-enoateFormula:
C24H28O10Smiles:
O=C(C=CCc1ccc(O)c(O)c1)OCc1ccc(CC2OC(CO)C(O)C(O)C2O)c(O)c1Aglycone:
Cc1ccc(COC(=O)C=CCc2ccc(O)c(O)c2)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.38 |
| AlogP: | 0.03 | Num_rotatable_bonds: | 8 |
| MolWt: | 476.48 | Num_heavy_atoms: | 34 |
| TPSA: | 177.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD50262
Formula: C18H18O5
Smiles:
Cc1ccc(COC(=O)C=CCc2ccc(O)c(O)c2)cc1O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 2.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 314.34 | Num_heavy_atoms: | 23 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
