synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD111472 | 3.09 | 548.64 | C26H28O9S2 | Cc1ccc(S(=O)(=O)O[C@@H]2CO[C@@H](OCc3ccccc3)[C@H](OS(=O)(=O)c3ccc(C)cc3)[C@@H]2O)cc1 |
|
GD111474 | 3.09 | 548.64 | C26H28O9S2 | Cc1ccc(S(=O)(=O)O[C@H]2CO[C@@H](OCc3ccccc3)[C@H](OS(=O)(=O)c3ccc(C)cc3)[C@@H]2O)cc1 |
|
GD067192 | -1.84 | 350.33 | C16H18O7N2 | O=C1C=Cc2[nH]cc(/C=C\NC[C@@]3(O)OC[C@@H](O)[C@@H](O)[C@H]3O)c2C1=O |
|
GD067194 | -1.84 | 350.33 | C16H18O7N2 | O=C1C=Cc2[nH]cc(/C=C/NC[C@]3(O)OC[C@@H](O)[C@@H](O)[C@H]3O)c2C1=O |
|
GD109678 | 2.35 | 577.61 | C27H31O11NS | COc1ccc(/C=N\[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](COS(=O)(=O)c3ccc(C)cc3)O[C@@H]2OC(C)=O)cc1 |
|
GD109679 | 2.35 | 577.61 | C27H31O11NS | COc1ccc(/C=N\[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COS(=O)(=O)c3ccc(C)cc3)O[C@@H]2OC(C)=O)cc1 |
|
GD108745 | 1.73 | 535.57 | C25H29O10NS | CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@H](OC(C)=O)[C@@H](NC(=O)c2ccccc2)[C@H]1OC(C)=O |
|
GD108746 | 1.73 | 535.57 | C25H29O10NS | CO[C@@H]1O[C@@H](COS(=O)(=O)c2ccc(C)cc2)[C@H](OC(C)=O)[C@@H](NC(=O)c2ccccc2)[C@H]1OC(C)=O |
|
GD041521 | -2.65 | 207.23 | C8H17O5N | CN(C)[C@@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD041811 | -2.65 | 207.23 | C8H17O5N | CN(C)[C@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O |