synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD106009 | -1.68 | 676.63 | C28H40O17N2 | CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@@H](COC(C)=O)O[C@@H](OC(C)=O)[C@@H](NC(C)=O)[C@H]2OC(C)=O)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD106007 | -1.68 | 676.63 | C28H40O17N2 | CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@@H](COC(C)=O)O[C@@H](OC(C)=O)[C@@H](NC(C)=O)[C@H]2OC(C)=O)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD106006 | -1.68 | 676.63 | C28H40O17N2 | CC(=O)N[C@@H]1[C@H](O[C@@H]2[C@H](COC(C)=O)O[C@@H](OC(C)=O)[C@@H](NC(C)=O)[C@H]2OC(C)=O)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD106008 | -1.68 | 676.63 | C28H40O17N2 | CC(=O)N[C@@H]1[C@H](OC(C)=O)O[C@@H](COC(C)=O)[C@@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2NC(C)=O)[C@@H]1OC(C)=O |
|
GD108815 | 3.16 | 587.43 | C27H24O10Cl2S | O=C1C=C/C(=C(/c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(Cl)c2)c2ccccc2S(O)(O)O)C=C1Cl |
|
GD107405 | 0.55 | 813.76 | C36H47O20N | CC(=O)OC[C@H]1O[C@@H](O[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OCCNC(=O)OCc3ccccc3)O[C@@H]2COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD110127 | 2.63 | 547.56 | C30H29O9N | O=C(CCCCn1cc(C(=O)c2cccc3ccccc23)c2ccccc21)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O |
|
GD110128 | 2.71 | 519.55 | C29H29O8N | O=C(c1cccc2ccccc12)c1cn(CCCCO[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12 |
|
GD112589 | 4.19 | 710.74 | C34H30O13S2 | CO[C@@H]1O[C@H](COS(=O)(=O)c2ccccc2)[C@@H](OC(=O)S(=O)(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD112367 | 4.16 | 562.62 | C32H34O9 | CO[C@H]1O[C@H](OCC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |