Glycoside
GD146214
Name:
methyl 3-(4,7-dimethoxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1-benzofuran-5-yl)propanoateFormula:
C20H26O11Smiles:
COC(=O)CCc1c(OC2OC(CO)C(O)C(O)C2O)c(OC)c2occc2c1OCAglycone:
COC(=O)CCc1c(O)c(OC)c2occc2c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 8 |
| MolWt: | 442.42 | Num_heavy_atoms: | 31 |
| TPSA: | 157.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD58642
Formula: C14H16O6
Smiles:
COC(=O)CCc1c(O)c(OC)c2occc2c1OC| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 2.26 | Num_rotatable_bonds: | 5 |
| MolWt: | 280.28 | Num_heavy_atoms: | 20 |
| TPSA: | 78.13 | NumAromaticRings: | 2 |
