synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113105 | 6.26 | 572.72 | C34H36O6S | COc1ccc(CO[C@H]2[C@H](OCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](Sc3ccccc3)O[C@@H]2CO)cc1 |
|
GD108006 | 1.28 | 535.51 | C28H25O10N | CC(=O)N[C@H]1[C@H](Oc2ccc3c(c2)Oc2cc(O)ccc2[C@]32OC(=O)c3ccccc32)O[C@H](CO)[C@@H](O)[C@@H]1O |
|
GD108005 | 1.28 | 535.51 | C28H25O10N | CC(=O)N[C@H]1[C@H](Oc2ccc3c(c2)Oc2cc(O)ccc2[C@@]32OC(=O)c3ccccc32)O[C@H](CO)[C@@H](O)[C@@H]1O |
|
GD107414 | 0.47 | 534.56 | C27H34O11 | COc1ccc(C[C@H]2COC(=O)[C@@H]2Cc2ccc(O[C@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(OC)c2)cc1OC |
|
GD042460 | -0.53 | 241.24 | C11H15O5N | O[C@@H]1CO[C@H](ONc2ccccc2)[C@H](O)[C@@H]1O |
|
GD082977 | -0.4 | 403.38 | C17H25O10N | CCC(=O)N[C@@H]1[C@H](OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD052290 | -0.94 | 321.34 | C14H19O4N5 | C=CCN(C)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
|
GD108007 | 1.82 | 561.41 | C21H25O9N2SBr | CC(=O)OC[C@@H]1O[C@@H](NC(=S)Nc2ccccc2Br)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD093689 | -1.75 | 478.47 | C19H26O12S | COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]2C(COC(=O)SC)=C[C@@H](O)[C@H]12 |
|
GD077210 | -0.52 | 390.34 | C16H22O11 | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](C=O)OC(C)=O |