Glycoside
GD120452
Name:
Creoside IFormula:
C14H24O7Smiles:
CC(=O)CCC=C(C)COC1OC(CO)C(O)C(O)C1OAglycone:
CC(=O)CCC=C(C)COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 7 |
| MolWt: | 304.34 | Num_heavy_atoms: | 21 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD48393
Formula: C8H14O2
Smiles:
CC(=O)CCC=C(C)CO| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.29 | Num_rotatable_bonds: | 4 |
| MolWt: | 142.2 | Num_heavy_atoms: | 10 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
