Glycoside
GD116880
Name:
5-(2-{[4-(acetyloxy)-3,5-dihydroxyoxan-2-yl]oxy}-2,5,5,8a-tetramethyl-decahydronaphthalen-1-yl)-3-methylpent-2-en-1-yl acetateFormula:
C29H48O8Smiles:
CC(=O)OCC=C(C)CCC1C(C)(OC2OCC(O)C(OC(C)=O)C2O)CCC2C(C)(C)CCCC21CAglycone:
CC(=O)OCC=C(C)CCC1C(C)(O)CCC2C(C)(C)CCCC21CSugarmoiety:
CC(=O)OC1C(O)COC(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 4.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 524.7 | Num_heavy_atoms: | 37 |
| TPSA: | 111.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD46502
Formula: C22H38O3
Smiles:
CC(=O)OCC=C(C)CCC1C(C)(O)CCC2C(C)(C)CCCC21C| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.86 |
| AlogP: | 5.27 | Num_rotatable_bonds: | 5 |
| MolWt: | 350.54 | Num_heavy_atoms: | 25 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
