synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD099802 | 0.8 | 472.45 | C24H24O10 | O=c1c(-c2ccc3c(c2)OCCCO3)coc2cc(O[C@H]3O[C@@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12 |
|
GD099531 | 0.8 | 472.45 | C24H24O10 | O=c1c(-c2ccc3c(c2)OCCCO3)coc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12 |
|
GD099532 | 0.72 | 472.45 | C24H24O10 | Cc1oc2cc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c(=O)c1-c1ccc2c(c1)OCCO2 |
|
GD062343 | -3.93 | 367.39 | C15H23O5N6 | C[NH+]1CCN(c2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)CC1 |
|
GD062346 | -3.93 | 367.39 | C15H23O5N6 | C[NH+]1CCN(c2nc3c(=O)[nH]cnc3n2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)CC1 |
|
GD105790 | -4.77 | 520.58 | C22H40O10N4 | CC(=O)O[C@H](C(=O)NCC[NH+](C)C)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)NCC[NH+](C)C |
|
GD050399 | -1.13 | 315.23 | C12H13O9N | O=C(O)[C@@H]1O[C@@H](Oc2ccc([N+](=O)[O-])cc2)[C@@H](O)[C@@H](O)[C@@H]1O |
|
GD099416 | 0.68 | 453.4 | C20H23O11N | CC(=O)OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)Nc1ccc(C(=O)O)cc1 |
|
GD099418 | 0.68 | 453.4 | C20H23O11N | CC(=O)OC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)Nc1ccc(C(=O)O)cc1 |
|
GD089113 | -0.47 | 427.41 | C18H25O9N3 | CCCCn1c(=O)cnn([C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)c1=O |