synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD046862 | -3.52 | 313.27 | C11H15O6N5 | Nc1nc2c([nH]c(=O)n2C[C@H]2O[C@@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1 |
|
GD060075 | -0.18 | 335.36 | C15H21O4N5 | CC(C)=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD085877 | 0.33 | 403.41 | C16H21O9NS | CC(=O)OC[C@H]1O[C@@H](SCC#N)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD046512 | 0.8 | 266.29 | C14H18O5 | COC(=O)CC[C@@H]1O[C@@H](c2ccccc2)[C@@H](O)[C@H]1O |
|
GD058929 | -0.94 | 348.3 | C14H20O10 | CC(=O)OC[C@@H]1O[C@@H](O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD093705 | -7.92 | 468.62 | C20H46O7N5 | C[NH2+]C[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@@H](O[C@H]3OC[C@](C)(O)[C@@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD093706 | -7.92 | 468.62 | C20H46O7N5 | C[NH2+]C[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@@H](O[C@H]3OC[C@@](C)(O)[C@@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD093703 | -7.92 | 468.62 | C20H46O7N5 | C[NH2+]C[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@@H](O[C@@H]3OC[C@](C)(O)[C@@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD093704 | -7.92 | 468.62 | C20H46O7N5 | C[NH2+]C[C@H]1CC[C@@H]([NH3+])[C@@H](O[C@H]2[C@@H]([NH3+])C[C@@H]([NH3+])[C@@H](O[C@@H]3OC[C@@](C)(O)[C@@H]([NH2+]C)[C@H]3O)[C@H]2O)O1 |
|
GD040797 | -2.54 | 164.16 | C6H12O5 | OC[C@@H]1OC[C@H](O)[C@@H](O)[C@H]1O |