Glycoside
GD101661
Name:
NoneFormula:
C19H21O7NF2S2Smiles:
O=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@@H](O)[C@H]2O)cc1Aglycone:
O=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 7 |
| MolWt: | 477.51 | Num_heavy_atoms: | 31 |
| TPSA: | 136.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD43039
Formula: C13H11O2NF2S2
Smiles:
O=S(=O)(Cc1cc(F)ccc1F)Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 3.2 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.37 | Num_heavy_atoms: | 20 |
| TPSA: | 46.17 | NumAromaticRings: | 2 |
