Glycoside
GD150126
Name:
6-[(4,6,7-trihydroxy-3,7,11-trimethyldodeca-2,10-dien-1-yl)oxy]hexane-1,2,3,4,5-pentolFormula:
C21H40O9Smiles:
CC(C)=CCCC(C)(O)C(O)CC(O)C(C)=CCOCC(O)C(O)C(O)C(O)COAglycone:
CC=C(C)C(O)CC(O)C(C)(O)CCC=C(C)CSugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 9 | RingCount: | 0 |
| HBD: | 8 | FractionCSP3: | 0.81 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 15 |
| MolWt: | 436.54 | Num_heavy_atoms: | 30 |
| TPSA: | 171.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD59986
Formula: C15H28O3
Smiles:
CC=C(C)C(O)CC(O)C(C)(O)CCC=C(C)C| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.73 |
| AlogP: | 2.56 | Num_rotatable_bonds: | 7 |
| MolWt: | 256.39 | Num_heavy_atoms: | 18 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
