Glycoside
GD156665
Name:
2-[(3,7-dimethylocta-2,6-dien-1-yl)oxy]-6-({[5-(hydroxymethyl)-3,4-dimethyloxolan-2-yl]oxy}methyl)oxane-3,4,5-triolFormula:
C23H40O8Smiles:
CC(C)=CCCC(C)=CCOC1OC(COC2OC(CO)C(C)C2C)C(O)C(O)C1OAglycone:
CC(C)=CCCC(C)=CCO.COC1OC(CO)C(C)C1CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 10 |
| MolWt: | 444.57 | Num_heavy_atoms: | 31 |
| TPSA: | 117.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD04659
Formula: C10H18O
Smiles:
CC(C)=CCCC(C)=CCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 154.25 | Num_heavy_atoms: | 11 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD56994
Formula: C8H16O3
Smiles:
COC1OC(CO)C(C)C1C| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 2 |
| MolWt: | 160.21 | Num_heavy_atoms: | 11 |
| TPSA: | 38.69 | NumAromaticRings: | 0 |
