synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD070558 | 0.75 | 374.41 | C16H22O8S | CO[C@@H]1O[C@H](C)[C@H](O)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@@H]1OC(C)=O |
|
GD058979 | -0.34 | 334.17 | C12H16O5NBr | OC[C@H](O)[C@@H]1O[C@H](Nc2ccc(Br)cc2)[C@H](O)[C@@H]1O |
|
GD052075 | -0.55 | 300.27 | C12H16O7N2 | COc1ccc(N[C@@H]2OC[C@H](O)[C@H](O)[C@@H]2O)c([N+](=O)[O-])c1 |
|
GD046114 | -0.25 | 284.27 | C12H16O6N2 | Cc1ccc([N+](=O)[O-])cc1N[C@@H]1OC[C@H](O)[C@H](O)[C@@H]1O |
|
GD062152 | 0.23 | 328.32 | C14H20O7N2 | CCOc1ccc(N[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@@H]2O)c([N+](=O)[O-])c1 |
|
GD042472 | -0.76 | 241.24 | C11H15O5N | Oc1ccc(N[C@@H]2OC[C@H](O)[C@@H](O)[C@H]2O)cc1 |
|
GD040554 | -3.97 | 180.18 | C6H14O5N | [NH3+][C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@H]1O |
|
GD088910 | -2.94 | 443.46 | C17H29O7N7 | OC[C@H](O)[C@H](O)[C@H](O)[C@H](O)C/N=N/c1nc(N2CCOCC2)nc(N2CCOCC2)n1 |
|
GD085410 | 0.93 | 408.4 | C20H24O9 | Cc1cc(=O)oc2cc(O[C@]3(C)O[C@H](C(=O)O)[C@@](C)(O)[C@](C)(O)[C@]3(C)O)ccc12 |
|
GD113843 | 6.85 | 582.74 | C37H42O6 | C[C@@]1(OCc2ccccc2)[C@H](COCc2ccccc2)O[C@@H](O)[C@](C)(OCc2ccccc2)[C@]1(C)OCc1ccccc1 |