synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD114013 | 5.27 | 616.84 | C36H56O8 | CC1(C)[C@@H](O[C@@H]2C[C@H](O)[C@H](O)[C@H](CO)O2)CC[C@]2(C)[C@@H]3C(=O)C=C4[C@H]5C[C@@](C)(C(=O)O)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12 |
|
GD114014 | 5.27 | 616.84 | C36H56O8 | CC1(C)[C@@H](O[C@@H]2C[C@H](O)[C@H](O)[C@H](CO)O2)CC[C@]2(C)[C@@H]3C(=O)C=C4[C@@H]5C[C@@](C)(C(=O)O)CC[C@]5(C)CC[C@@]4(C)[C@]3(C)CC[C@@H]12 |
|
GD100128 | 0.09 | 474.51 | C24H30O8N2 | CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)[C@H]1O |
|
GD100129 | 0.09 | 474.51 | C24H30O8N2 | CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OCc2ccccc2)[C@H]1O |
|
GD044758 | -2.34 | 278.3 | C6H14O8S2 | CS(=O)(=O)O[C@H](CO)[C@@H](CO)OS(C)(=O)=O |
|
GD044754 | -2.34 | 278.3 | C6H14O8S2 | CS(=O)(=O)O[C@@H](CO)[C@H](CO)OS(C)(=O)=O |
|
GD111470 | 3.39 | 606.67 | C28H30O11S2 | COc1ccc(C(=O)O[C@H]2[C@@H](OC)OC[C@@H](OS(=O)(=O)c3ccc(C)cc3)[C@H]2OS(=O)(=O)c2ccc(C)cc2)cc1 |
|
GD111471 | 3.39 | 606.67 | C28H30O11S2 | COc1ccc(C(=O)O[C@H]2[C@@H](OC)OC[C@H](OS(=O)(=O)c3ccc(C)cc3)[C@H]2OS(=O)(=O)c2ccc(C)cc2)cc1 |
|
GD111469 | 3.39 | 606.67 | C28H30O11S2 | COc1ccc(C(=O)O[C@@H]2[C@H](OS(=O)(=O)c3ccc(C)cc3)[C@H](OS(=O)(=O)c3ccc(C)cc3)CO[C@H]2OC)cc1 |
|
GD111468 | 3.39 | 606.67 | C28H30O11S2 | COc1ccc(C(=O)O[C@@H]2[C@H](OS(=O)(=O)c3ccc(C)cc3)[C@@H](OS(=O)(=O)c3ccc(C)cc3)CO[C@H]2OC)cc1 |