synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD104769 | 2.05 | 616.57 | C30H32O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc4c(c3)OCCO4)c(O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD104771 | 2.05 | 616.57 | C30H32O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc4c(c3)OCCO4)c(O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD104770 | 2.05 | 616.57 | C30H32O14 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc4c(c3)OCCO4)c(O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD105104 | 3.23 | 618.98 | C30H27O13Cl | CC(=O)OC[C@@H]1O[C@H](Oc2cc3occ(-c4ccc(Cl)cc4)c(O)c-3c(=O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD105106 | 3.23 | 618.98 | C30H27O13Cl | CC(=O)OC[C@@H]1O[C@H](Oc2cc3occ(-c4ccc(Cl)cc4)c(O)c-3c(=O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD105105 | 3.23 | 618.98 | C30H27O13Cl | CC(=O)OC[C@@H]1O[C@H](Oc2cc3occ(-c4ccc(Cl)cc4)c(O)c-3c(=O)c2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD069830 | -0.91 | 363.37 | C17H21O6N3 | CN(C[C@H](O)[C@H](O)[C@@H](O)[C@@H](O)CO)c1oc(-c2ccccc2)nc1C#N |
|
GD069828 | -0.91 | 363.37 | C17H21O6N3 | CN(C[C@H](O)[C@H](O)[C@H](O)[C@H](O)CO)c1oc(-c2ccccc2)nc1C#N |
|
GD069829 | -0.91 | 363.37 | C17H21O6N3 | CN(C[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO)c1oc(-c2ccccc2)nc1C#N |
|
GD069838 | -0.91 | 363.37 | C17H21O6N3 | CN(C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)CO)c1oc(-c2ccccc2)nc1C#N |