synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD109496 | 2.2 | 566.37 | C23H21O11NCl2S | CC(=O)N[C@H]1[C@H](Oc2cc3sc(=O)oc3c(Cl)c2Cl)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD092686 | 0.48 | 440.26 | C17H15O8NCl2S | CC(=O)N[C@H]1[C@@H](Oc2cc3sc(=O)oc3c(Cl)c2Cl)O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD092685 | 0.48 | 440.26 | C17H15O8NCl2S | CC(=O)N[C@@H]1[C@@H](Oc2cc3sc(=O)oc3c(Cl)c2Cl)O[C@H](CO)[C@H](O)[C@@H]1O |
|
GD092683 | 0.48 | 440.26 | C17H15O8NCl2S | CC(=O)N[C@@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1Oc1cc2sc(=O)oc2c(Cl)c1Cl |
|
GD092684 | 0.48 | 440.26 | C17H15O8NCl2S | CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1Oc1cc2sc(=O)oc2c(Cl)c1Cl |
|
GD106549 | -0.47 | 796.73 | C35H44O19N2 | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C(=O)O[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](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD106550 | -0.47 | 796.73 | C35H44O19N2 | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C(=O)O[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](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD106547 | -0.47 | 796.73 | C35H44O19N2 | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C(=O)O[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](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD106548 | -0.47 | 796.73 | C35H44O19N2 | CC(=O)N[C@@H]1[C@H](Oc2ccccc2C(=O)O[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](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD108469 | 1.36 | 517.49 | C25H27O11N | CC(=O)N[C@@H]1[C@H](OC(=O)c2ccc3ccccc3c2O)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |