synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD082627 | -1.85 | 411.32 | C8H13O14NS2 | O=C(O)[C@@H](O)[C@H](O)C(=O)ON1C(=O)CC(S(O)(O)O)(S(O)(O)O)C1=O |
|
GD082629 | -1.85 | 411.32 | C8H13O14NS2 | O=C(O)[C@H](O)[C@@H](O)C(=O)ON1C(=O)CC(S(O)(O)O)(S(O)(O)O)C1=O |
|
GD082626 | -1.85 | 411.32 | C8H13O14NS2 | O=C(ON1C(=O)CC(S(O)(O)O)(S(O)(O)O)C1=O)[C@@H](O)[C@@H](O)C(=O)O |
|
GD044220 | -2.27 | 268.23 | C10H12O5N4 | O=c1[nH]cnc2c1cnn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |
|
GD110717 | 3.42 | 584.63 | C32H32O7N4 | COc1ccc(C(OC[C@H]2O[C@@H](n3cnc4c(=O)[nH]cnc43)[C@H](OC)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD104403 | 1.14 | 494.45 | C26H22O10 | O=C1O[C@@]2(c3ccc(O)cc3Oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc32)c2ccccc21 |
|
GD104404 | 1.14 | 494.45 | C26H22O10 | O=C1O[C@]2(c3ccc(O)cc3Oc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc32)c2ccccc21 |
|
GD095662 | -2.73 | 458.46 | C21H30O11 | C[C@H]1C[C@H]2O[C@@H]3[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C[C@@](C)([C@]34CO4)[C@@]2(CO)C(=O)C1=O |
|
GD114052 | 7.67 | 608.78 | C39H44O6 | C=CCCCO[C@H]1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
|
GD105649 | -1.68 | 543.48 | C14H25O17NS2 | CC(=O)N[C@H]1[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O[C@@H]2OC(C(=O)O)=C[C@H](O)[C@H]2OS(O)(O)O)[C@@H]1O |