Glycoside
GD010982
Name:
NoneFormula:
C26H27O7ClSmiles:
C#CC(C)(O)c1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c3c(c2Cl)OCC3)cc1Aglycone:
C#CC(C)(O)c1ccc(Cc2ccc3c(c2Cl)OCC3)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 474.94 | Num_heavy_atoms: | 33 |
| TPSA: | 119.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD08422
Formula: C20H17O2Cl
Smiles:
C#CC(C)(O)c1ccc(Cc2ccc3c(c2Cl)OCC3)cc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.26 |
| AlogP: | 3.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 312.8 | Num_heavy_atoms: | 22 |
| TPSA: | 29.46 | NumAromaticRings: | 2 |
