natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD085439 | 0.34 | 416.38 | C21H20O9 | O=c1cc(-c2ccccc2)oc2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12 |
|
GD085443 | 0.1 | 412.51 | C19H28O6N2S | CC1CCN(C(=O)C[C@@H]2O[C@H](CNS(=O)(=O)c3ccccc3)[C@@H](O)[C@H]2O)CC1 |
|
GD085444 | 0.24 | 406.48 | C21H30O6N2 | COC[C@H]1CCCN1C(=O)C[C@@H]1O[C@H](CNC(=O)c2ccc(C)cc2)[C@@H](O)[C@H]1O |
|
GD085446 | 0.24 | 408.4 | C20H24O9 | COc1cc(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc2cc(C)c(C(C)=O)c(O)c12 |
|
GD085449 | 0.24 | 408.4 | C20H24O9 | COc1cc(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc2cc(C)c(C(C)=O)c(O)c12 |
|
GD085450 | 0.24 | 408.4 | C20H24O9 | COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2c(O)c(C(C)=O)c(C)cc2c1 |
|
GD085451 | 0.24 | 408.4 | C20H24O9 | COc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc2cc(C)c(C(C)=O)c(O)c12 |
|
GD085452 | 0.75 | 404.42 | C21H24O8 | COc1ccc(/C=C/c2cc(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)cc1 |
|
GD085457 | 0.54 | 418.4 | C21H22O9 | O=C(/C=C/c1ccc(O)cc1)OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD085458 | 0.08 | 424.45 | C21H28O9 | O=C(/C=C/c1ccc(O)cc1)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O[C@H]1CCCC[C@H]1O |