Glycoside
GD152564
Name:
4,5-bis(acetyloxy)-6-({2-[4-methyl-3-oxo-4-(4-oxopentyl)cyclohexyl]propan-2-yl}oxy)oxan-3-yl acetateFormula:
C26H40O10Smiles:
CC(=O)CCCC1(C)CCC(C(C)(C)OC2OCC(OC(C)=O)C(OC(C)=O)C2OC(C)=O)CC1=OAglycone:
CC(=O)CCCC1(C)CCC(C(C)(C)O)CC1=OSugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.81 |
| AlogP: | 3.07 | Num_rotatable_bonds: | 10 |
| MolWt: | 512.6 | Num_heavy_atoms: | 36 |
| TPSA: | 131.5 | NumAromaticRings: | 0 |
Unique Aglycone
AD56793
Formula: C15H26O3
Smiles:
CC(=O)CCCC1(C)CCC(C(C)(C)O)CC1=O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.87 |
| AlogP: | 2.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 254.37 | Num_heavy_atoms: | 18 |
| TPSA: | 54.37 | NumAromaticRings: | 0 |
