Glycoside
GD092288
Name:
NoneFormula:
C19H20O8N2SSmiles:
N#Cc1cccc(S(=O)(=O)Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)c1Aglycone:
N#Cc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.32 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 6 |
| MolWt: | 436.44 | Num_heavy_atoms: | 30 |
| TPSA: | 169.34 | NumAromaticRings: | 2 |
Unique Aglycone
AD40268
Formula: C13H10O3N2S
Smiles:
N#Cc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.3 | Num_heavy_atoms: | 19 |
| TPSA: | 90.19 | NumAromaticRings: | 2 |
