synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD107714 | 0.68 | 584.6 | C24H32O11N4S | CSc1nc(N[C@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD107713 | 0.68 | 584.6 | C24H32O11N4S | CSc1nc(N[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD107716 | 0.75 | 512.54 | C21H28O9N4S | CSc1nc(N[C@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD107715 | 0.75 | 512.54 | C21H28O9N4S | CSc1nc(N[C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD112605 | 4.38 | 598.63 | C28H30O9N4S | CC(=O)OC[C@@H]1O[C@H](n2c(C)c(/N=N\c3ccccc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112604 | 4.38 | 598.63 | C28H30O9N4S | CC(=O)OC[C@@H]1O[C@@H](n2c(C)c(/N=N\c3ccccc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD093251 | 2.09 | 430.49 | C20H22O5N4S | Cc1c(/N=N\c2ccccc2)c(C)n([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=S)c1C#N |
|
GD093250 | 2.09 | 430.49 | C20H22O5N4S | Cc1c(/N=N\c2ccccc2)c(C)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=S)c1C#N |
|
GD093252 | 2.4 | 444.51 | C21H24O5N4S | Cc1ccc(/N=N\c2c(C)c(C#N)c(=S)n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2C)cc1 |
|
GD093249 | 2.4 | 444.51 | C21H24O5N4S | Cc1ccc(/N=N\c2c(C)c(C#N)c(=S)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)c2C)cc1 |