Glycoside
GD153095
Name:
2-{[3-hydroxy-4-(5-hydroxy-3-methylpent-3-en-1-yl)-8-(hydroxymethyl)-3,4a,8-trimethyl-decahydronaphthalen-1-yl]oxy}oxane-3,4,5-triolFormula:
C25H44O8Smiles:
CC(=CCO)CCC1C(C)(O)CC(OC2OCC(O)C(O)C2O)C2C(C)(CO)CCCC12CAglycone:
CC(=CCO)CCC1C(C)(O)CC(O)C2C(C)(CO)CCCC12CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.92 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 7 |
| MolWt: | 472.62 | Num_heavy_atoms: | 33 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD60916
Formula: C20H36O4
Smiles:
CC(=CCO)CCC1C(C)(O)CC(O)C2C(C)(CO)CCCC12C| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.9 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 5 |
| MolWt: | 340.5 | Num_heavy_atoms: | 24 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
