Glycoside
GD026294
Name:
NoneFormula:
C22H23O5FS2Smiles:
Cc1sc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(-c2ccc(F)cc2)s1Aglycone:
Cc1sccc1Cc1ccc(-c2ccc(F)cc2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | 3.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 450.55 | Num_heavy_atoms: | 30 |
| TPSA: | 90.15 | NumAromaticRings: | 3 |
Unique Aglycone
AD17341
Formula: C16H13FS2
Smiles:
Cc1sccc1Cc1ccc(-c2ccc(F)cc2)s1| HBA: | 0 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 5.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 288.41 | Num_heavy_atoms: | 19 |
| TPSA: | 0.0 | NumAromaticRings: | 3 |
