Glycoside
GD014545
Name:
NoneFormula:
C22H25O5ClSmiles:
CCOc1ccc(Cc2cc([C@@H]3OC(OC)C[C@H](O)[C@H]3O)ccc2Cl)cc1Aglycone:
CCOc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
COC1CC(O)C(O)C(O)O1Other Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 3.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.88 | Num_heavy_atoms: | 27 |
| TPSA: | 68.15 | 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 |
