Glycoside
GD042505
Name:
3-(benzyloxy)butane-1,2,4-triolFormula:
C11H16O4Smiles:
OC[C@@H](O)[C@@H](CO)OCc1ccccc1Aglycone:
Cc1ccccc1Sugarmoiety:
OCC(O)C(CO)OOOther Identifiers
Properties
| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 212.25 | Num_heavy_atoms: | 15 |
| TPSA: | 69.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD00274
Formula: C7H8
Smiles:
Cc1ccccc1| HBA: | 0 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 92.14 | Num_heavy_atoms: | 7 |
| TPSA: | 0.0 | NumAromaticRings: | 1 |
