synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD045608 | -0.05 | 298.29 | C14H18O7 | COc1ccc(C(=O)O[C@H]2[C@@H](OC)OC[C@@H](O)[C@@H]2O)cc1 |
|
GD045605 | -0.05 | 298.29 | C14H18O7 | COc1ccc(C(=O)O[C@@H]2[C@@H](OC)OC[C@@H](O)[C@@H]2O)cc1 |
|
GD067955 | -0.85 | 369.33 | C15H19O8N3 | CC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD067925 | -0.85 | 369.33 | C15H19O8N3 | CC(=O)OC[C@@H]1O[C@@H](n2ccc(N)nc2=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111502 | 3.34 | 616.56 | C27H24O13N2S | CO[C@H]1OC[C@@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OC(=O)c1ccccc1 |
|
GD111499 | 3.34 | 616.56 | C27H24O13N2S | CO[C@H]1OC[C@@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OC(=O)c1ccccc1 |
|
GD111500 | 3.34 | 616.56 | C27H24O13N2S | CO[C@H]1OC[C@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OC(=O)c1ccccc1 |
|
GD111501 | 3.34 | 616.56 | C27H24O13N2S | CO[C@H]1OC[C@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](OS(=O)(=O)c2ccc(C)cc2)[C@H]1OC(=O)c1ccccc1 |
|
GD107522 | 0.38 | 574.54 | C28H30O13 | COc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@@H]1OC)[C@@H](OC)[C@](C)(O)C3=O |
|
GD107524 | 0.38 | 574.54 | C28H30O13 | COc1cc(O)c2c(c1)C(=O)c1cc3c(c(O)c1C2=O)[C@@H](O[C@@H]1O[C@@H](C)[C@H](O)[C@H](O)[C@@H]1OC)[C@@H](OC)[C@](C)(O)C3=O |