synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109924 | 2.58 | 664.38 | C25H22O12N5Br | CC(=O)O[C@H]1[C@H](OC(C)=O)CO[C@H](N2C(=O)/C(=N\Nc3ccc([N+](=O)[O-])cc3)c3cc(Br)c([N+](=O)[O-])cc32)[C@@H]1OC(C)=O |
|
GD109923 | 2.58 | 664.38 | C25H22O12N5Br | CC(=O)O[C@@H]1[C@@H](N2C(=O)/C(=N\Nc3ccc([N+](=O)[O-])cc3)c3cc(Br)c([N+](=O)[O-])cc32)OC[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD106893 | 0.77 | 616.57 | C26H36O15N2 | CCOC(=O)N1[C@H](C(=O)OC)C=C[C@@H](O[C@@H]2O[C@H](CC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)N1C(=O)OCC |
|
GD106894 | 0.77 | 616.57 | C26H36O15N2 | CCOC(=O)N1[C@H](O[C@@H]2O[C@H](CC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)C=C[C@H](C(=O)OC)N1C(=O)OCC |
|
GD106891 | 0.77 | 616.57 | C26H36O15N2 | CCOC(=O)N1[C@H](C(=O)OC)C=C[C@@H](O[C@@H]2O[C@H](CC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)N1C(=O)OCC |
|
GD106892 | 0.77 | 616.57 | C26H36O15N2 | CCOC(=O)N1[C@H](O[C@@H]2O[C@H](CC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)C=C[C@H](C(=O)OC)N1C(=O)OCC |
|
GD104491 | 1.91 | 499.49 | C21H25O11NS | CC(=O)OC[C@@H]1O[C@H](SCc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD104493 | 1.91 | 499.49 | C21H25O11NS | CC(=O)OC[C@@H]1O[C@H](SCc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD104494 | 1.91 | 499.49 | C21H25O11NS | CC(=O)OC[C@@H]1O[C@H](SCc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD104492 | 1.91 | 499.49 | C21H25O11NS | CC(=O)OC[C@@H]1O[C@H](SCc2ccc([N+](=O)[O-])cc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |