synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD059365 | 0.0 | 329.74 | C15H16O6NCl | OC[C@@H]1O[C@H](Oc2c[nH]c3cc(Cl)ccc23)[C@H](O)[C@H](O)[C@@H]1O |
|
GD059030 | 0.0 | 329.74 | C15H16O6NCl | OC[C@@H]1O[C@H](Oc2c[nH]c3cc(Cl)ccc23)[C@@H](O)[C@H](O)[C@@H]1O |
|
GD085660 | 0.64 | 400.38 | C21H20O8 | O=c1cc(-c2ccccc2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]3O)ccc12 |
|
GD085661 | 0.64 | 400.38 | C21H20O8 | O=c1cc(-c2ccccc2)oc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12 |
|
GD085694 | 0.64 | 400.38 | C21H20O8 | O=c1cc(-c2ccccc2)oc2cc(O[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]3O)ccc12 |
|
GD111257 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@]6(C)CC[C@H](C(C)(C)O)O6)[C@@H](O)C[C@@]3(C)[C@@H]5C[C@H](O)[C@@H]4C2(C)C)OC[C@@H](O)[C@@H]1O |
|
GD111285 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@]6(C)CC[C@H](C(C)(C)O)O6)[C@@H](O)C[C@@]3(C)[C@@H]5C[C@H](O)[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O |
|
GD092521 | 0.3 | 446.41 | C22H22O10 | COc1cc2oc(-c3ccccc3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c-2c(=O)c1 |
|
GD107424 | 0.99 | 613.77 | C30H47O10NS | CO[C@@H]1O[C@H](CS(=O)(=O)N[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@@H]3C2)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD107400 | 0.99 | 613.77 | C30H47O10NS | CO[C@@H]1O[C@H](CS(=O)(=O)N[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@H]4CC[C@@H]3C2)[C@H](O)[C@@H](O)[C@@H]1O |