synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD093457 | -2.02 | 465.5 | C20H35O11N | CCCO[C@H]1[C@@H]([C@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)O[C@@H]2OC(C)(C)O[C@H]12 |
|
GD093451 | -2.02 | 465.5 | C20H35O11N | CCCO[C@H]1[C@@H]([C@@H](O)CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2NC(C)=O)O[C@@H]2OC(C)(C)O[C@H]12 |
|
GD106336 | -0.31 | 591.61 | C26H41O14N | CCCO[C@H]1[C@@H]([C@H](O)CO[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2NC(C)=O)O[C@@H]2OC(C)(C)O[C@H]12 |
|
GD106335 | -0.31 | 591.61 | C26H41O14N | CCCO[C@H]1[C@@H]([C@@H](O)CO[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2NC(C)=O)O[C@@H]2OC(C)(C)O[C@H]12 |
|
GD093456 | -1.66 | 463.48 | C20H33O11N | CC(=O)N[C@H]1[C@H](OC[C@H]2O[C@@H]3OC(C)(C)O[C@@H]3[C@H]3OC(C)(C)O[C@H]32)O[C@H](CO)[C@@H](O)[C@@H]1O |
|
GD106642 | -0.29 | 630.65 | C31H38O12N2 | O=c1c(-c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2)coc2c(CN3CCOCC3)c(O)c(CN3CCOCC3)c(O)c12 |
|
GD110844 | 3.06 | 586.52 | C29H27O12F | CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccccc4F)coc3c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109167 | 2.12 | 604.56 | C29H32O14 | COc1ccc(OCC(=O)c2ccc(O[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3OC(C)=O)cc2O)cc1 |
|
GD109508 | 2.12 | 604.56 | C29H32O14 | COc1ccc(OCC(=O)c2ccc(O[C@@H]3O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]3OC(C)=O)cc2O)cc1 |
|
GD109164 | 2.12 | 604.56 | C29H32O14 | COc1ccc(OCC(=O)c2ccc(O[C@@H]3O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)cc2O)cc1 |