Glycoside
GD154014
Name:
4,5-bis(acetyloxy)-2-methyl-6-{[2-(4-methylcyclohex-3-en-1-yl)-5-oxopentan-2-yl]oxy}oxan-3-yl acetateFormula:
C24H36O9Smiles:
CC(=O)OC1C(C)OC(OC(C)(CCC=O)C2CC=C(C)CC2)C(OC(C)=O)C1OC(C)=OAglycone:
CC1=CCC(C(C)(O)CCC=O)CC1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 468.54 | Num_heavy_atoms: | 33 |
| TPSA: | 114.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD61212
Formula: C12H20O2
Smiles:
CC1=CCC(C(C)(O)CCC=O)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 196.29 | Num_heavy_atoms: | 14 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
