synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD106881 | 0.92 | 606.61 | C26H30O11N4S | COc1ccc(/C=C\c2nn([C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3OC(C)=O)c(=S)n(N)c2=O)cc1 |
|
GD106880 | 0.92 | 606.61 | C26H30O11N4S | COc1ccc(/C=C/c2nn([C@@H]3O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3OC(C)=O)c(=S)n(N)c2=O)cc1 |
|
GD110873 | 3.32 | 646.7 | C29H30O11N2S2 | COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2S[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1 |
|
GD110733 | 3.32 | 646.7 | C29H30O11N2S2 | COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2S[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)cc1 |
|
GD109215 | 2.5 | 562.6 | C26H30O10N2S | CC(=O)OC[C@@H]1O[C@H](SC2=NC(=C(C)C)C(=O)N2c2ccccc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109216 | 2.5 | 562.6 | C26H30O10N2S | CC(=O)OC[C@@H]1O[C@H](SC2=NC(=C(C)C)C(=O)N2c2ccccc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD109217 | 2.5 | 562.6 | C26H30O10N2S | CC(=O)OC[C@@H]1O[C@H](SC2=NC(=C(C)C)C(=O)N2c2ccccc2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD051054 | 0.51 | 321.35 | C12H19O7NS | C[C@@H]1O[C@H](Nc2ccc(S(O)(O)O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD051055 | 0.51 | 321.35 | C12H19O7NS | C[C@@H]1O[C@H](Nc2ccc(S(O)(O)O)cc2)[C@H](O)[C@@H](O)[C@H]1O |
|
GD051053 | 0.51 | 321.35 | C12H19O7NS | C[C@@H]1O[C@H](Nc2ccc(S(O)(O)O)cc2)[C@H](O)[C@H](O)[C@H]1O |