synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD111974 | 4.0 | 582.61 | C33H30O8N2 | C[C@@]1(OC(=O)c2ccccc2)[C@@H](N2C=CCC(C(N)=O)=C2)O[C@@H](COC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |
|
GD082646 | -1.59 | 401.44 | C17H23O8NS | CC1(C)C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(=O)C2=C1SCC(=O)N2 |
|
GD110899 | 1.91 | 563.73 | C30H43O3N8 | CC(C)[N@@H+](C[C@@H]1O[C@H](n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O)[C@H]1C[C@@H](CCc2nc3ccc(C(C)(C)C)cc3[nH]2)C1 |
|
GD043617 | -2.75 | 287.23 | C10H13O7N3 | NC(=O)OC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@H](O)[C@H]1O |
|
GD043616 | -2.75 | 287.23 | C10H13O7N3 | NC(=O)OC[C@@H]1O[C@H](n2ccc(=O)[nH]c2=O)[C@@H](O)[C@H]1O |
|
GD107845 | 1.82 | 561.41 | C21H25O9N2SBr | CC(=O)OC[C@@H]1O[C@@H](NC(=S)Nc2ccccc2Br)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD046311 | -1.65 | 294.41 | C14H32O5N | CCCCCCCC[NH2+]C[C@H](O)[C@H](O)[C@H](O)[C@@H](O)CO |
|
GD046309 | -1.65 | 294.41 | C14H32O5N | CCCCCCCC[NH2+]C[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO |
|
GD109241 | 2.04 | 670.67 | C33H38O13N2 | CC(=O)N[C@H]1[C@@H](O[C@H](C)[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD109240 | 2.47 | 671.65 | C33H37O14N | CC(=O)OC[C@H]1O[C@@H](O[C@H](C)[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O |