synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108444 | 1.35 | 517.5 | C23H27O9N5 | CC(=O)O[C@H]1CO[C@@H](Nc2nc(NCc3ccccc3)n(C)c(=O)c2N=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD059072 | -1.52 | 336.28 | C13H21O8P | O[C@@H]1CO[C@](O)(CO[PH](O)(O)Cc2ccccc2)[C@H](O)[C@@H]1O |
|
GD059078 | -1.52 | 336.28 | C13H21O8P | O[C@@H]1CO[C@@](O)(CO[PH](O)(O)Cc2ccccc2)[C@H](O)[C@@H]1O |
|
GD042821 | -1.13 | 286.28 | C13H18O7 | COc1ccc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc1 |
|
GD112236 | 3.97 | 591.04 | C28H27O9N2ClS | CC(=O)OC[C@@H]1O[C@H](n2c(C)cc(-c3ccc(Cl)cc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112232 | 3.97 | 591.04 | C28H27O9N2ClS | CC(=O)OC[C@@H]1O[C@@H](n2c(C)cc(-c3ccc(Cl)cc3)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112231 | 3.97 | 591.04 | C28H27O9N2ClS | CC(=O)OC[C@@H]1O[C@H](n2c(C)cc(-c3ccc(Cl)cc3)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD112228 | 3.97 | 591.04 | C28H27O9N2ClS | CC(=O)OC[C@@H]1O[C@@H](n2c(C)cc(-c3ccc(Cl)cc3)c(C#N)c2=S)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110636 | 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 |
|
GD110638 | 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 |