Glycoside
GD024304
Name:
NoneFormula:
C22H21O5F3S2Smiles:
OC[C@@H]1O[C@H](c2ccc(C(F)(F)F)c(Cc3ccc(-c4ccsc4)s3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
FC(F)(F)c1ccccc1Cc1ccc(-c2ccsc2)s1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.36 |
| AlogP: | 3.6 | Num_rotatable_bonds: | 5 |
| MolWt: | 486.53 | Num_heavy_atoms: | 32 |
| TPSA: | 90.15 | NumAromaticRings: | 3 |
Unique Aglycone
AD16234
Formula: C16H11F3S2
Smiles:
FC(F)(F)c1ccccc1Cc1ccc(-c2ccsc2)s1| HBA: | 0 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 6.09 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.39 | Num_heavy_atoms: | 21 |
| TPSA: | 0.0 | NumAromaticRings: | 3 |
