synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108121 | 0.2 | 550.65 | C27H36O9NS | CCSc1ccc2c(cc1=O)[C@@H]([NH2+][C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)CCc1cc(OC)c(OC)c(OC)c1-2 |
|
GD108120 | 0.2 | 550.65 | C27H36O9NS | CCSc1ccc2c(cc1=O)[C@@H]([NH2+][C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)CCc1cc(OC)c(OC)c(OC)c1-2 |
|
GD086225 | 3.65 | 410.47 | C24H26O6 | C/C=C/c1ccc2oc(-c3ccc(O[C@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]4O)cc3)c(C)c2c1 |
|
GD086226 | 3.65 | 410.47 | C24H26O6 | C/C=C/c1ccc2oc(-c3ccc(O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@H]4O)cc3)c(C)c2c1 |
|
GD109564 | 2.42 | 601.62 | C24H23O8N7S2 | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2nc(SCc3ccc([N+](=O)[O-])cc3)n([C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1 |
|
GD109566 | 2.42 | 601.62 | C24H23O8N7S2 | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2nc(SCc3ccc([N+](=O)[O-])cc3)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)c2n1 |
|
GD109565 | 2.42 | 601.62 | C24H23O8N7S2 | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2nc(SCc3ccc([N+](=O)[O-])cc3)n([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1 |
|
GD109567 | 2.42 | 601.62 | C24H23O8N7S2 | Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2nc(SCc3ccc([N+](=O)[O-])cc3)n([C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)c2n1 |
|
GD067857 | -0.94 | 355.3 | C15H17O9N | CC(=O)OC[C@H]1O[C@@H](N2C(=O)C=CC2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD067858 | -0.94 | 355.3 | C15H17O9N | CC(=O)OC[C@@H]1O[C@@H](N2C(=O)C=CC2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |