synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110639 | 2.91 | 546.55 | C25H26O10N2S | CC(=O)OC[C@@H]1O[C@H](n2c(C)cc(-c3ccco3)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110637 | 2.91 | 546.55 | C25H26O10N2S | CC(=O)OC[C@@H]1O[C@@H](n2c(C)cc(-c3ccco3)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112230 | 3.58 | 600.65 | C29H32O10N2S | CCc1cc(-c2ccc(OC)cc2)c(C#N)c(=S)n1[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD112227 | 3.58 | 600.65 | C29H32O10N2S | CCc1cc(-c2ccc(OC)cc2)c(C#N)c(=S)n1[C@@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD112237 | 3.58 | 600.65 | C29H32O10N2S | CCc1cc(-c2ccc(OC)cc2)c(C#N)c(=S)n1[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112238 | 3.58 | 600.65 | C29H32O10N2S | CCc1cc(-c2ccc(OC)cc2)c(C#N)c(=S)n1[C@@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111528 | 3.17 | 560.58 | C26H28O10N2S | CCc1cc(-c2ccco2)c(C#N)c(=S)n1[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111527 | 3.17 | 560.58 | C26H28O10N2S | CCc1cc(-c2ccco2)c(C#N)c(=S)n1[C@@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111526 | 3.17 | 560.58 | C26H28O10N2S | CCc1cc(-c2ccco2)c(C#N)c(=S)n1[C@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111530 | 3.17 | 560.58 | C26H28O10N2S | CCc1cc(-c2ccco2)c(C#N)c(=S)n1[C@@H]1O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |