synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD111173 | 3.1 | 705.71 | C37H39O13N | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)OC[C@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)coc3c2)[C@@H](O)[C@H](O)[C@@H]1O |
|
GD110813 | 3.1 | 705.71 | C37H39O13N | CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)OC[C@@H]1O[C@@H](Oc2ccc3c(=O)c(-c4ccc5c(c4)OCCO5)coc3c2)[C@@H](O)[C@H](O)[C@@H]1O |
|
GD107293 | -0.29 | 700.71 | C31H40O11N8 | Cc1ncnc2c1ncn2[C@H]1O[C@@H](COC(=O)CCCCCCCCC(=O)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O |
|
GD107296 | -0.29 | 700.71 | C31H40O11N8 | Cc1ncnc2c1ncn2[C@@H]1O[C@@H](COC(=O)CCCCCCCCC(=O)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O |
|
GD107294 | -0.29 | 700.71 | C31H40O11N8 | Cc1ncnc2c1ncn2[C@H]1O[C@@H](COC(=O)CCCCCCCCC(=O)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O |
|
GD107295 | -0.29 | 700.71 | C31H40O11N8 | Cc1ncnc2c1ncn2[C@@H]1O[C@@H](COC(=O)CCCCCCCCC(=O)OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H]1O |
|
GD114100 | 6.04 | 674.73 | C34H34O9N4S | CC(=O)OC[C@@H]1O[C@H](n2c(-c3ccccc3)c(/N=N\c3ccc(C)cc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD114101 | 6.04 | 674.73 | C34H34O9N4S | CC(=O)OC[C@@H]1O[C@@H](n2c(-c3ccccc3)c(/N=N\c3ccc(C)cc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD114103 | 6.39 | 695.15 | C34H31O9N4ClS | CC(=O)OC[C@@H]1O[C@H](n2c(-c3ccccc3)c(/N=N\c3ccc(Cl)cc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD114102 | 6.39 | 695.15 | C34H31O9N4ClS | CC(=O)OC[C@@H]1O[C@@H](n2c(-c3ccccc3)c(/N=N\c3ccc(Cl)cc3)c(C)c(C#N)c2=S)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |