Glycoside
GD015888
Name:
NoneFormula:
C19H36O9Smiles:
CCCCCCCCCC(=O)OC[C@@H]1O[C@H](OC(CO)CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
CCCCCCCCCC(=O)OC.OCC(O)COSugarmoiety:
OCC(CO)OC(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.95 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 14 |
| MolWt: | 408.49 | Num_heavy_atoms: | 28 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD00405
Formula: C3H8O3
Smiles:
OCC(O)CO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -1.67 | Num_rotatable_bonds: | 2 |
| MolWt: | 92.09 | Num_heavy_atoms: | 6 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
AD02592
Formula: C11H22O2
Smiles:
CCCCCCCCCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.91 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 8 |
| MolWt: | 186.29 | Num_heavy_atoms: | 13 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
