Glycoside
GD119181
Name:
(8-methoxy-6-methyl-4-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-oxatricyclo[4.3.0.0³,â¹]nonan-9-yl)methyl benzoateFormula:
C24H30O11Smiles:
COC1OC2(C)CC(=O)C3CC2(OC2OC(CO)C(O)C(O)C2O)C13COC(=O)c1ccccc1Aglycone:
COC1OC2(C)CC(=O)C3CC2(O)C13COC(=O)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.86 | Num_rotatable_bonds: | 7 |
| MolWt: | 494.49 | Num_heavy_atoms: | 35 |
| TPSA: | 161.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD08967
Formula: C18H20O6
Smiles:
COC1OC2(C)CC(=O)C3CC2(O)C13COC(=O)c1ccccc1| HBA: | 6 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.56 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.35 | Num_heavy_atoms: | 24 |
| TPSA: | 82.06 | NumAromaticRings: | 1 |
