Glycoside
GD101151
Name:
NoneFormula:
C17H18O7NF3S2Smiles:
O=S(=O)(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1csc(C(F)(F)F)c1-c1ccccc1Aglycone:
NS(=O)(=O)c1csc(C(F)(F)F)c1-c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.51 | Num_rotatable_bonds: | 5 |
| MolWt: | 469.46 | Num_heavy_atoms: | 30 |
| TPSA: | 136.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD42753
Formula: C11H8O2NF3S2
Smiles:
NS(=O)(=O)c1csc(C(F)(F)F)c1-c1ccccc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 3.08 | Num_rotatable_bonds: | 2 |
| MolWt: | 307.32 | Num_heavy_atoms: | 19 |
| TPSA: | 60.16 | NumAromaticRings: | 2 |
