Glycoside
GD016311
Name:
NoneFormula:
C21H23O6ClSmiles:
[2H]C([2H])([2H])Oc1ccc(C([2H])([2H])c2cc([C@]3([2H])O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1Aglycone:
COc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 1.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 400.89 | Num_heavy_atoms: | 27 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD07245
Formula: C15H13OCl
Smiles:
COc1ccc(Cc2ccccc2Cl)cc1| HBA: | 1 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 232.71 | Num_heavy_atoms: | 16 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
