synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD093435 | -1.37 | 475.43 | C17H21O11N3S | CC(=O)OC[C@@H]1O[C@H](Sc2n[nH]c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD106898 | 0.77 | 551.62 | C25H33O9N3S | CC(=O)OC[C@@H]1O[C@H](NC(=S)N2CCN(c3ccccc3)CC2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107784 | 1.58 | 565.55 | C25H27O12NS | CC(=O)OC[C@@H]1O[C@H](COc2ccc(C(=O)c3cscn3)c(O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD104740 | 2.41 | 491.52 | C23H25O9NS | CC(=O)OC[C@@H]1O[C@H](Sc2cccc3cccnc23)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD113063 | 5.3 | 607.66 | C35H33O7N3 | Cc1ccc(C(=O)OC[C@@H]2O[C@H](N3NNc4ccccc43)[C@H](OC(=O)c3ccc(C)cc3)[C@@H]2OC(=O)c2ccc(C)cc2)cc1 |
|
GD113062 | 5.3 | 607.66 | C35H33O7N3 | Cc1ccc(C(=O)OC[C@@H]2O[C@H](N3NNc4ccccc43)[C@H](OC(=O)c3ccc(C)cc3)[C@H]2OC(=O)c2ccc(C)cc2)cc1 |
|
GD058932 | -0.92 | 348.36 | C16H20O5N4 | Nc1nc([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)[nH]c1C(=O)NCc1ccccc1 |
|
GD113068 | 7.14 | 552.71 | C36H40O5 | CC[C@@H]1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |
|
GD044221 | -1.32 | 284.26 | C13H16O7 | O=Cc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)cc1 |
|
GD071027 | -2.05 | 383.43 | C16H27O5N6 | [NH3+]CCCCCCNc1nc2c(=O)[nH]cnc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@@H]1O |