Glycoside
GD100816
Name:
NoneFormula:
C19H22O8NFS2Smiles:
COc1ccc(F)c(S(=O)(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)c1Aglycone:
COc1ccc(F)c(S(=O)(=O)Nc2ccc(S)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 475.52 | Num_heavy_atoms: | 31 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD42586
Formula: C13H12O3NFS2
Smiles:
COc1ccc(F)c(S(=O)(=O)Nc2ccc(S)cc2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.92 | Num_rotatable_bonds: | 4 |
| MolWt: | 313.38 | Num_heavy_atoms: | 20 |
| TPSA: | 55.4 | NumAromaticRings: | 2 |
