Glycoside
GD099376
Name:
NoneFormula:
C19H19O8N2FSSmiles:
N#Cc1cc(S(=O)(=O)Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)ccc1FAglycone:
N#Cc1cc(S(=O)(=O)Nc2ccc(O)cc2)ccc1FSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.32 | Num_rotatable_bonds: | 6 |
| MolWt: | 454.43 | Num_heavy_atoms: | 31 |
| TPSA: | 169.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD42263
Formula: C13H9O3N2FS
Smiles:
N#Cc1cc(S(=O)(=O)Nc2ccc(O)cc2)ccc1F| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 292.29 | Num_heavy_atoms: | 20 |
| TPSA: | 90.19 | NumAromaticRings: | 2 |
