synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD112394 | 4.35 | 731.78 | C37H37O11N3S | CCCC[C@H](Sc1nn([C@@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O)C(=O)OCC |
|
GD112395 | 4.35 | 731.78 | C37H37O11N3S | CCCC[C@@H](Sc1nn([C@@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O)C(=O)OCC |
|
GD108384 | 1.9 | 669.72 | C32H47O14N | CC(=O)N[C@H]1[C@@H](OC[C@H]2O[C@@H]3O[C@]4(CCCCC4)O[C@@H]3[C@H]3O[C@]4(CCCCC4)O[C@@H]32)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD108382 | 1.9 | 669.72 | C32H47O14N | CC(=O)N[C@@H]1[C@@H](OC[C@H]2O[C@@H]3O[C@]4(CCCCC4)O[C@@H]3[C@H]3O[C@]4(CCCCC4)O[C@@H]32)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD108383 | 1.9 | 669.72 | C32H47O14N | CC(=O)N[C@H]1[C@@H](OC[C@H]2O[C@@H]3O[C@]4(CCCCC4)O[C@@H]3[C@H]3O[C@]4(CCCCC4)O[C@@H]32)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD108385 | 1.9 | 669.72 | C32H47O14N | CC(=O)N[C@@H]1[C@@H](OC[C@H]2O[C@@H]3O[C@]4(CCCCC4)O[C@@H]3[C@H]3O[C@]4(CCCCC4)O[C@@H]32)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD113765 | 6.55 | 631.47 | C35H24O7N2Cl2 | O=C(OC[C@H]1O[C@@H](n2cnc3cc(Cl)c(Cl)cc32)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113764 | 6.55 | 631.47 | C35H24O7N2Cl2 | O=C(OC[C@@H]1O[C@@H](n2cnc3cc(Cl)c(Cl)cc32)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113763 | 6.55 | 631.47 | C35H24O7N2Cl2 | O=C(OC[C@H]1O[C@@H](n2cnc3cc(Cl)c(Cl)cc32)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD113762 | 6.55 | 631.47 | C35H24O7N2Cl2 | O=C(OC[C@@H]1O[C@@H](n2cnc3cc(Cl)c(Cl)cc32)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |