synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113228 | 5.8 | 695.78 | C36H29O8N3S2 | O=C(OC[C@@H]1O[C@H](n2nc(SCc3ccccc3)c(=S)[nH]c2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113230 | 5.8 | 695.78 | C36H29O8N3S2 | O=C(OC[C@@H]1O[C@@H](n2nc(SCc3ccccc3)c(=S)[nH]c2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113229 | 5.8 | 695.78 | C36H29O8N3S2 | O=C(OC[C@@H]1O[C@H](n2nc(SCc3ccccc3)c(=S)[nH]c2=O)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113233 | 5.8 | 695.78 | C36H29O8N3S2 | O=C(OC[C@@H]1O[C@@H](n2nc(SCc3ccccc3)c(=S)[nH]c2=O)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113232 | 5.81 | 725.8 | C37H31O9N3S2 | COc1ccc(CSc2nn([C@H]3O[C@@H](COC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@H]3OC(=O)c3ccccc3)c(=O)[nH]c2=S)cc1 |
|
GD113231 | 5.81 | 725.8 | C37H31O9N3S2 | COc1ccc(CSc2nn([C@@H]3O[C@@H](COC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@H]3OC(=O)c3ccccc3)c(=O)[nH]c2=S)cc1 |
|
GD113234 | 5.81 | 725.8 | C37H31O9N3S2 | COc1ccc(CSc2nn([C@H]3O[C@@H](COC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@@H]3OC(=O)c3ccccc3)c(=O)[nH]c2=S)cc1 |
|
GD113235 | 5.81 | 725.8 | C37H31O9N3S2 | COc1ccc(CSc2nn([C@@H]3O[C@@H](COC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@@H]3OC(=O)c3ccccc3)c(=O)[nH]c2=S)cc1 |
|
GD112393 | 4.35 | 731.78 | C37H37O11N3S | CCCC[C@H](Sc1nn([C@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O)C(=O)OCC |
|
GD112396 | 4.35 | 731.78 | C37H37O11N3S | CCCC[C@@H](Sc1nn([C@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O)C(=O)OCC |