synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD108228 | 1.51 | 525.53 | C23H27O11NS | CC(=O)N[C@@H]1[C@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD108227 | 1.51 | 525.53 | C23H27O11NS | CC(=O)N[C@@H]1[C@H](Oc2cc3sc(=O)oc3c(C)c2C)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD077558 | 0.73 | 389.4 | C20H23O7N | CC(=O)N[C@@H]1[C@H](Oc2cccc3ccccc23)O[C@H](CO)[C@H](O)[C@H]1OC(C)=O |
|
GD077557 | 0.73 | 389.4 | C20H23O7N | CC(=O)N[C@@H]1[C@H](Oc2cccc3ccccc23)O[C@H](CO)[C@H](O)[C@@H]1OC(C)=O |
|
GD077560 | 0.73 | 389.4 | C20H23O7N | CC(=O)N[C@@H]1[C@H](Oc2cccc3ccccc23)O[C@H](CO)[C@@H](O)[C@H]1OC(C)=O |
|
GD077559 | 0.73 | 389.4 | C20H23O7N | CC(=O)N[C@@H]1[C@H](Oc2cccc3ccccc23)O[C@H](CO)[C@@H](O)[C@@H]1OC(C)=O |
|
GD093470 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@@H]1CC[C@H]([NH3+])[C@H](O[C@@H]2[C@H]([NH3+])C[C@H]([NH3+])[C@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@@H]2O)O1 |
|
GD093468 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@@H]1CC[C@H]([NH3+])[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@@H]3O)[C@@H]([NH3+])C[C@H]2[NH3+])O1 |
|
GD093469 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@@H]1CC[C@H]([NH3+])[C@H](O[C@@H]2[C@H]([NH3+])C[C@H]([NH3+])[C@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@@H]3O)[C@@H]2O)O1 |
|
GD093467 | -7.53 | 482.64 | C21H48O7N5 | C[NH2+][C@H](C)[C@@H]1CC[C@H]([NH3+])[C@H](O[C@H]2[C@H](O)[C@@H](O[C@@H]3OC[C@](C)(O)[C@H]([NH2+]C)[C@H]3O)[C@@H]([NH3+])C[C@H]2[NH3+])O1 |