Glycoside
GD006027
Name:
NoneFormula:
C22H27O7ClSSmiles:
CCOCCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)sc2Cl)cc1Aglycone:
CCOCCOc1ccc(Cc2ccsc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.52 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 9 |
| MolWt: | 458.96 | Num_heavy_atoms: | 30 |
| TPSA: | 108.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD05026
Formula: C16H17O2ClS
Smiles:
CCOCCOc1ccc(Cc2ccsc2Cl)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 4.41 | Num_rotatable_bonds: | 7 |
| MolWt: | 296.82 | Num_heavy_atoms: | 19 |
| TPSA: | 18.46 | NumAromaticRings: | 2 |
