synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD105204 | 3.0 | 640.59 | C32H32O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)c(C)oc3c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD105205 | 3.0 | 640.59 | C32H32O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)c(C)oc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD093545 | -5.02 | 750.47 | C21H35O17N7P3 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@@H](O)[C@H]2O)c1 |
|
GD093544 | -5.02 | 750.47 | C21H35O17N7P3 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@H](O)[C@@H]2O)c1 |
|
GD093542 | -5.02 | 750.47 | C21H35O17N7P3 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@H](O)[C@H]2O)c1 |
|
GD093543 | -5.02 | 750.47 | C21H35O17N7P3 | NC(=O)c1ccc[n+]([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O[PH](O)(O)O)[C@@H]3O)[C@@H](O)[C@@H]2O)c1 |
|
GD085252 | -0.13 | 403.4 | C18H21O6N5 | CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cc1 |
|
GD085253 | -0.13 | 403.4 | C18H21O6N5 | CCOc1ccc(Nc2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1 |
|
GD079102 | -3.35 | 411.36 | C13H13O7N7S | O=c1[nH]nc(Sc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1 |
|
GD079101 | -3.35 | 411.36 | C13H13O7N7S | O=c1[nH]nc(Sc2nc3c(=O)[nH]cnc3n2[C@H]2O[C@@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1 |