Glycoside
GD023253
Name:
NoneFormula:
C22H25O6ClSmiles:
[2H]C([2H])(c1ccc(OC([2H])([2H])C([2H])([2H])[2H])cc1)c1cc([C@]2([2H])O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)ccc1ClAglycone:
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: | 7 |
| MolWt: | 416.93 | 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 |
