Glycoside
GD016625
Name:
2-{4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C22H25O6ClSmiles:
CCOc1ccc(Cc2cc(C3OC(CO)C(O)C(O)C3O)ccc2Cl)cc1Aglycone:
CCOc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.88 | Num_heavy_atoms: | 28 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD00288
Formula: C16H15OCl
Smiles:
CCOc1ccc(Cc2ccccc2Cl)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.2 |
| AlogP: | 4.33 | Num_rotatable_bonds: | 4 |
| MolWt: | 246.74 | Num_heavy_atoms: | 17 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
