Glycoside
GD116485
Name:
2-{[6-hydroxy-5-(5-hydroxy-3-methylpent-3-en-1-yl)-1,4a,6-trimethyl-decahydronaphthalen-1-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C26H46O8Smiles:
CC(=CCO)CCC1C(C)(O)CCC2C(C)(COC3OC(CO)C(O)C(O)C3O)CCCC12CAglycone:
CC(=CCO)CCC1C(C)(O)CCC2C(C)(CO)CCCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 8 |
| MolWt: | 486.65 | Num_heavy_atoms: | 34 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD46261
Formula: C20H36O3
Smiles:
CC(=CCO)CCC1C(C)(O)CCC2C(C)(CO)CCCC12C| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.51 | Num_heavy_atoms: | 23 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
