Glycoside
GD151134
Name:
4,5-bis(acetyloxy)-2-methyl-6-{[6-methyl-2-(4-methylcyclohex-3-en-1-yl)-5-oxohept-6-en-2-yl]oxy}oxan-3-yl acetateFormula:
C27H40O9Smiles:
C=C(C)C(=O)CCC(C)(OC1OC(C)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O)C1CC=C(C)CC1Aglycone:
C=C(C)C(=O)CCC(C)(O)C1CC=C(C)CC1Sugarmoiety:
CC(=O)OC1C(C)OC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.7 |
| AlogP: | 3.97 | Num_rotatable_bonds: | 10 |
| MolWt: | 508.61 | Num_heavy_atoms: | 36 |
| TPSA: | 114.43 | NumAromaticRings: | 0 |
Unique Aglycone
AD60304
Formula: C15H24O2
Smiles:
C=C(C)C(=O)CCC(C)(O)C1CC=C(C)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | 3.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 236.35 | Num_heavy_atoms: | 17 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
