Glycoside
GD128687
Name:
NoneFormula:
C17H26O3Smiles:
CCCCCCOC1CCC(OCc2ccccc2)O1Aglycone:
CCCCCCO.OCc1ccccc1Sugarmoiety:
OC1CCC(O)O1Other Identifiers
Properties
| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.65 |
| AlogP: | 4.26 | Num_rotatable_bonds: | 9 |
| MolWt: | 278.39 | Num_heavy_atoms: | 20 |
| TPSA: | 27.69 | NumAromaticRings: | 1 |
Unique Aglycone
AD00044
Formula: C7H8O
Smiles:
OCc1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 108.14 | Num_heavy_atoms: | 8 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
AD00066
Formula: C6H14O
Smiles:
CCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 4 |
| MolWt: | 102.18 | Num_heavy_atoms: | 7 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
