Glycoside
GD131323
Name:
Sonchuside EFormula:
C21H30O9Smiles:
C=C1C(=O)OC2C1CCC1(C)C(OC3OC(CO)C(O)C(O)C3O)CCC(C=O)C21Aglycone:
C=C1C(=O)OC2C1CCC1(C)C(O)CCC(C=O)C21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 426.46 | Num_heavy_atoms: | 30 |
| TPSA: | 142.75 | NumAromaticRings: | 0 |
Unique Aglycone
AD53206
Formula: C15H20O4
Smiles:
C=C1C(=O)OC2C1CCC1(C)C(O)CCC(C=O)C21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.73 |
| AlogP: | 1.47 | Num_rotatable_bonds: | 1 |
| MolWt: | 264.32 | Num_heavy_atoms: | 19 |
| TPSA: | 63.6 | NumAromaticRings: | 0 |
