synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD111574 | 2.2 | 619.59 | C28H41O4N7Br | CC(C)[N@@H+](CCCNC(=O)Nc1ccc(C(C)(C)C)cc1)C[C@H]1O[C@@H](n2cc(Br)c3c(N)ncnc32)[C@H](O)[C@@H]1O |
|
GD110048 | 2.85 | 587.63 | C32H33O8N3 | COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(C)=O)nc3=O)[C@H](O)[C@@H]2O)(c2ccccc2)c2ccc(OC)cc2)cc1 |
|
GD110941 | 3.49 | 547.6 | C31H33O8N | O=C(c1cccc2ccccc12)c1cn(CCCCCCO[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)c2ccccc12 |
|
GD108681 | 1.89 | 521.53 | C25H27O6N7 | COc1cc(C/N=N/c2nc3c(N)ncnc3n2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1OCc1ccccc1 |
|
GD111282 | 3.07 | 616.62 | C31H36O13 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc(OC(C)C)cc3)c(O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111283 | 3.07 | 616.62 | C31H36O13 | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)Cc3ccc(OC(C)C)cc3)c(O)c2)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111281 | 3.07 | 616.62 | C31H36O13 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc(C(=O)Cc3ccc(OC(C)C)cc3)c(O)c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111284 | 3.07 | 616.62 | C31H36O13 | CC(=O)OC[C@@H]1O[C@@H](Oc2ccc(C(=O)Cc3ccc(OC(C)C)cc3)c(O)c2)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD114141 | 5.97 | 752.82 | C42H44O11N2 | CCCCCCCCOC(=O)/C=C/c1c(C)[nH]c(=O)n([C@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c1=O |
|
GD114138 | 5.97 | 752.82 | C42H44O11N2 | CCCCCCCCOC(=O)/C=C/c1c(C)[nH]c(=O)n([C@@H]2O[C@@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c1=O |