Glycoside
GD034985
Name:
NoneFormula:
C22H20O5FClS2Smiles:
OC[C@@H]1O[C@H](c2cc(Cc3ccc(-c4ccc(F)cc4)s3)c(Cl)s2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Fc1ccc(-c2ccc(Cc3ccsc3Cl)s2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 470.97 | Num_heavy_atoms: | 30 |
| TPSA: | 90.15 | NumAromaticRings: | 3 |
Unique Aglycone
AD22173
Formula: C16H10FClS2
Smiles:
Fc1ccc(-c2ccc(Cc3ccsc3Cl)s2)cc1| HBA: | 0 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.07 |
| AlogP: | 5.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 308.83 | Num_heavy_atoms: | 19 |
| TPSA: | 0.0 | NumAromaticRings: | 3 |
