synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD105783 | -1.7 | 693.61 | C28H39O19N | CC(=O)OC[C@@H](OC(C)=O)[C@H](O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)C(N)=O |
|
GD105784 | -1.7 | 693.61 | C28H39O19N | CC(=O)OC[C@H]1O[C@@H](O[C@@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)C(N)=O)[C@@H](COC(C)=O)OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD107768 | 0.75 | 520.44 | C24H24O13 | CC(=O)OC[C@H]1O[C@@H](OC2=CC(=O)c3cccc(O)c3C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107769 | 0.75 | 520.44 | C24H24O13 | CC(=O)OC[C@H]1O[C@@H](OC2=CC(=O)c3c(O)cccc3C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD113209 | 3.98 | 626.68 | C36H36O9N | C[C@@H]([NH2+]C[C@@H](COCc1ccccc1)OC(=O)[C@@H](OC(=O)c1ccccc1)[C@@H](OC(=O)c1ccccc1)C(=O)O)c1ccccc1 |
|
GD113210 | 7.81 | 645.8 | C41H43O6N | COc1ccc(N[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1 |
|
GD106683 | -0.66 | 675.59 | C28H37O18N | CC(=O)OC[C@@H](OC(C)=O)[C@H](O[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)[C@@H](OC(C)=O)[C@@H](C#N)OC(C)=O |
|
GD111425 | 3.24 | 626.73 | C27H30O11S3 | CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OS(=O)(=O)c1ccc(C)cc1 |
|
GD045526 | -1.57 | 281.29 | C12H17O4N4 | C[C@]1(O)[C@@H](O)[C@@H](CO)O[C@@H]1n1ccc2c(N)[nH+]cnc21 |
|
GD109519 | 2.08 | 550.69 | C30H46O9 | CO[C@H]1[C@@H](O)[C@@H](C)O[C@@H](O[C@@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@H](C6=CC(=O)OC6)[C@H](O)C[C@]5(O)[C@@H]4CC[C@@H]3C2)[C@@H]1O |