Glycoside
GD128842
Name:
Cussoside EFormula:
C31H52O11Smiles:
C=C1CCC2C(C)(COC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)CCCC2(C)C1CCC(C)=CCOAglycone:
C=C1CCC2C(C)(CO)CCCC2(C)C1CCC(C)=CCOSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.87 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 11 |
| MolWt: | 600.75 | Num_heavy_atoms: | 42 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD52188
Formula: C20H34O2
Smiles:
C=C1CCC2C(C)(CO)CCCC2(C)C1CCC(C)=CCO| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 4.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 306.49 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
