synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108926 | 1.11 | 520.52 | C22H24O9N4S | CC(=O)OC[C@@H]1O[C@@H](n2c(N)c(C#N)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD108924 | 1.11 | 520.52 | C22H24O9N4S | CC(=O)OC[C@@H]1O[C@H](n2c(N)c(C#N)c(C)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD108927 | 1.11 | 520.52 | C22H24O9N4S | CC(=O)OC[C@@H]1O[C@@H](n2c(N)c(C#N)c(C)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110622 | 2.53 | 510.53 | C24H22O7N4S | CC(=O)O[C@@H]1CO[C@H](n2c(N)c(C#N)c(-c3ccccc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110626 | 2.53 | 510.53 | C24H22O7N4S | CC(=O)O[C@H]1CO[C@H](n2c(N)c(C#N)c(-c3ccccc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110624 | 2.53 | 510.53 | C24H22O7N4S | CC(=O)O[C@@H]1CO[C@@H](n2c(N)c(C#N)c(-c3ccccc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110623 | 2.53 | 510.53 | C24H22O7N4S | CC(=O)O[C@H]1CO[C@@H](n2c(N)c(C#N)c(-c3ccccc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110625 | 2.54 | 540.55 | C25H24O8N4S | COc1ccc(-c2c(C#N)c(N)n([C@H]3OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]3OC(C)=O)c(=S)c2C#N)cc1 |
|
GD110627 | 2.54 | 540.55 | C25H24O8N4S | COc1ccc(-c2c(C#N)c(N)n([C@H]3OC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]3OC(C)=O)c(=S)c2C#N)cc1 |
|
GD110628 | 2.54 | 540.55 | C25H24O8N4S | COc1ccc(-c2c(C#N)c(N)n([C@@H]3OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]3OC(C)=O)c(=S)c2C#N)cc1 |