Glycoside
GD148847
Name:
Funingenoside AFormula:
C44H66O19Smiles:
COC1CC(OC2CCC3(C)C(CCC45CCC(C6=CC(=O)OC6)C(C)(CCC43)C5=O)C2OC(C)=O)OC(C)C1OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
CC(=O)OC1C(O)CCC2(C)C1CCC13CCC(C4=CC(=O)OC4)C(C)(CCC12)C3=OSugarmoiety:
COC1CC(O)OC(C)C1OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 8 |
| HBD: | 7 | FractionCSP3: | 0.89 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 11 |
| MolWt: | 898.99 | Num_heavy_atoms: | 63 |
| TPSA: | 275.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD59086
Formula: C25H34O6
Smiles:
CC(=O)OC1C(O)CCC2(C)C1CCC13CCC(C4=CC(=O)OC4)C(C)(CCC12)C3=O| HBA: | 6 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 3.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 430.54 | Num_heavy_atoms: | 31 |
| TPSA: | 89.9 | NumAromaticRings: | 0 |
