Glycoside
GD120939
Name:
6-{[2-(3-acetyl-3a-hydroxy-7a-methyl-octahydro-1H-inden-5-yl)propan-2-yl]oxy}-4,5-bis(acetyloxy)oxan-3-yl acetateFormula:
C26H40O10Smiles:
CC(=O)OC1COC(OC(C)(C)C2CCC3(C)CCC(C(C)=O)C3(O)C2)C(OC(C)=O)C1OC(C)=OAglycone:
CC(=O)C1CCC2(C)CCC(C(C)(C)O)CC12OSugarmoiety:
CC(=O)OC1COC(O)C(OC(C)=O)C1OC(C)=OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.85 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 512.6 | Num_heavy_atoms: | 36 |
| TPSA: | 134.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD48633
Formula: C15H26O3
Smiles:
CC(=O)C1CCC2(C)CCC(C(C)(C)O)CC12O| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.93 |
| AlogP: | 2.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 254.37 | Num_heavy_atoms: | 18 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
