Glycoside
GD156079
Name:
JaspolinalosideFormula:
C27H40O12Smiles:
C=CC(C)(O)CCC=C(C)COC(=O)CC1C(C(=O)OC)=COC(OC2OC(CO)C(O)C(O)C2O)C1=CCAglycone:
C=CC(C)(O)CCC=C(C)COC(=O)CC1C(C(=O)OC)=COC(O)C1=CCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 12 |
| MolWt: | 556.61 | Num_heavy_atoms: | 39 |
| TPSA: | 181.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD55544
Formula: C21H30O7
Smiles:
C=CC(C)(O)CCC=C(C)COC(=O)CC1C(C(=O)OC)=COC(O)C1=CC| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.52 |
| AlogP: | 2.55 | Num_rotatable_bonds: | 9 |
| MolWt: | 394.46 | Num_heavy_atoms: | 28 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
