synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD114092 | 7.9 | 798.91 | C47H42O10S | CO[C@H]1O[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD114094 | 7.9 | 798.91 | C47H42O10S | CO[C@H]1O[C@@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD114091 | 7.9 | 798.91 | C47H42O10S | CO[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD114093 | 7.9 | 798.91 | C47H42O10S | CO[C@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD109539 | -0.7 | 724.94 | C40H60O8N4 | O=C(O[C@@H](CN1CCCc2ccccc21)C[NH+]1CCCCC1)[C@H](O)[C@H](O)[C@@](O)(CO)C(=O)O[C@H](CN1CCCc2ccccc21)C[NH+]1CCCCC1 |
|
GD109424 | 2.13 | 722.92 | C40H58O8N4 | O=C(O[C@@H](CN1CCCCC1)CN1CCCc2ccccc21)[C@H](O)[C@H](O)[C@@](O)(CO)C(=O)O[C@@H](CN1CCCCC1)CN1CCCc2ccccc21 |
|
GD112960 | 4.61 | 710.78 | C35H34O12S2 | CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H]1OS(=O)(=O)c1ccc(C)cc1 |
|
GD112961 | 4.61 | 710.78 | C35H34O12S2 | CO[C@@H]1O[C@@H](COS(=O)(=O)c2ccc(C)cc2)[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H]1OS(=O)(=O)c1ccc(C)cc1 |
|
GD112959 | 4.61 | 710.78 | C35H34O12S2 | CO[C@@H]1O[C@H](COS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H]1OS(=O)(=O)c1ccc(C)cc1 |
|
GD112958 | 4.61 | 710.78 | C35H34O12S2 | CO[C@@H]1O[C@@H](COS(=O)(=O)c2ccc(C)cc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H]1OS(=O)(=O)c1ccc(C)cc1 |