synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD107467 | 0.5 | 528.43 | C20H24O13N4 | CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](NNc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@@H]1OC(C)=O |
|
GD107442 | 0.5 | 528.43 | C20H24O13N4 | CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](NNc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@@H]1OC(C)=O |
|
GD107466 | 0.5 | 528.43 | C20H24O13N4 | CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](NNc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@@H]1OC(C)=O |
|
GD107443 | 0.5 | 528.43 | C20H24O13N4 | CC(=O)OC[C@@H]1O[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](NNc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@@H]1OC(C)=O |
|
GD110587 | 3.52 | 598.61 | C29H34O10N4 | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)/C(=C/N=N/c1ccccc1)NNc1ccccc1 |
|
|
GD110587 | 3.52 | 598.61 | C29H34O10N4 | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)/C(=C/N=N/c1ccccc1)NNc1ccccc1 |
|
|
GD110587 | 3.52 | 598.61 | C29H34O10N4 | CC(=O)OC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)/C(=C/N=N/c1ccccc1)NNc1ccccc1 |
|
GD044720 | -1.11 | 255.27 | C12H17O5N | OC[C@@H](O)[C@@H](O)[C@@H](O)C/N=C\c1ccccc1O |
|
GD044719 | -1.11 | 255.27 | C12H17O5N | OC[C@@H](O)[C@@H](O)[C@H](O)C/N=C/c1ccccc1O |
|
GD104578 | 1.91 | 481.52 | C22H27O9NS | COc1ccc(/C=N\[C@H]2[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](CSC(C)=O)O[C@@H]2OC(C)=O)cc1 |