synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD092739 | 0.59 | 429.48 | C21H27O5N5 | O=C(Nc1ncnc2c1ncn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O)[C@]12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |
|
GD083064 | 0.44 | 420.39 | C16H20O11S | Cc1cc(=O)oc2cc(O[C@H]3O[C@@H](COS(O)(O)O)[C@@H](O)[C@@H](O)[C@H]3O)ccc12 |
|
GD083065 | 0.44 | 420.39 | C16H20O11S | Cc1cc(=O)oc2cc(O[C@@H]3O[C@@H](COS(O)(O)O)[C@@H](O)[C@@H](O)[C@H]3O)ccc12 |
|
GD093180 | 1.03 | 442.33 | C17H18O12N2 | CC(=O)O[C@@H]1CO[C@H](Oc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD093179 | 1.03 | 442.33 | C17H18O12N2 | CC(=O)O[C@@H]1CO[C@@H](Oc2ccc([N+](=O)[O-])c([N+](=O)[O-])c2)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD095914 | -0.2 | 490.51 | C24H30O9N2 | CO[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)OCc2ccccc2)[C@H]1O |
|
GD096010 | -0.2 | 490.51 | C24H30O9N2 | CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)OCc2ccccc2)[C@H]1O |
|
GD086364 | -5.21 | 427.44 | C17H27O7N6 | O=c1[nH]cnc2c1nc(N1CC[NH+](C[C@H](O)CO)CC1)n2[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1O |
|
GD086363 | -5.21 | 427.44 | C17H27O7N6 | O=c1[nH]cnc2c1nc(N1CC[NH+](C[C@H](O)CO)CC1)n2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1O |
|
GD106635 | -0.5 | 519.46 | C20H29O13N3 | CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@@H](N[C@@H]2CC[C@H]([N+](=O)[O-])C[C@@H]2[N+](=O)[O-])[C@@H](OC(C)=O)[C@@H]1OC(C)=O |