synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113913 | 7.45 | 689.76 | C41H39O9N | O=C(O[C@@H]1O[C@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 |
|
GD113911 | 7.45 | 689.76 | C41H39O9N | O=C(O[C@@H]1O[C@@H](COCc2ccccc2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 |
|
GD113912 | 7.45 | 689.76 | C41H39O9N | O=C(O[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 |
|
GD113910 | 7.45 | 689.76 | C41H39O9N | O=C(O[C@@H]1O[C@@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1)c1ccc([N+](=O)[O-])cc1 |
|
GD112614 | 4.29 | 697.58 | C28H29O10N2S2Br | COc1ccc(-c2c(Br)c(SC)nc(S[C@H]3O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]3OC(C)=O)c2C#N)cc1 |
|
GD114076 | 6.69 | 679.8 | C35H53O12N | CCCCCCCCCCCCCCCc1cc(O[C@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)ccc1[N+](=O)[O-] |
|
GD114074 | 6.69 | 679.8 | C35H53O12N | CCCCCCCCCCCCCCCc1cc(O[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)ccc1[N+](=O)[O-] |
|
GD114077 | 6.69 | 679.8 | C35H53O12N | CCCCCCCCCCCCCCCc1cc(O[C@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)ccc1[N+](=O)[O-] |
|
GD114079 | 6.69 | 679.8 | C35H53O12N | CCCCCCCCCCCCCCCc1cc(O[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O)ccc1[N+](=O)[O-] |
|
GD113696 | 8.06 | 775.77 | C41H37O11N5 | O=C(Nc1ccccc1)OC[C@H]1O[C@@H](OC(=O)Nc2ccccc2)[C@@H](OC(=O)Nc2ccccc2)[C@@H](OC(=O)Nc2ccccc2)[C@H]1OC(=O)Nc1ccccc1 |