synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD040925 | -2.72 | 149.1 | C4H7O5N | NC(=O)[C@@H](O)[C@@H](O)C(=O)O |
|
GD040927 | -2.72 | 149.1 | C4H7O5N | NC(=O)[C@H](O)[C@@H](O)C(=O)O |
|
GD108054 | 1.92 | 777.89 | C40H47O6N11 | CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(C(=O)NCCNC(=O)NC4CCN(c5ccccn5)CC4)nc32)[C@H](O)[C@@H]1O |
|
GD105700 | -4.42 | 751.45 | C21H34O18N6P3 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]2O[C@H]([n+]3cccc(C(=O)O)c3)[C@@H](O)[C@H]2O)[C@@H](O)[C@H]1O[PH](O)(O)O |
|
GD106602 | -0.06 | 772.86 | C35H52O10N10 | CCOC(=O)NC(=O)c1cn(CCN2CCN(C(=O)CCCCCCCCCCNc3ncnc4c3ncn4[C@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)CC2)c(=O)[nH]c1=O |
|
GD106599 | -0.06 | 772.86 | C35H52O10N10 | CCOC(=O)NC(=O)c1cn(CCN2CCN(C(=O)CCCCCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@@H](CO)[C@@H](O)[C@H]3O)CC2)c(=O)[nH]c1=O |
|
GD106601 | -0.06 | 772.86 | C35H52O10N10 | CCOC(=O)NC(=O)c1cn(CCN2CCN(C(=O)CCCCCCCCCCNc3ncnc4c3ncn4[C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)CC2)c(=O)[nH]c1=O |
|
GD106600 | -0.06 | 772.86 | C35H52O10N10 | CCOC(=O)NC(=O)c1cn(CCN2CCN(C(=O)CCCCCCCCCCNc3ncnc4c3ncn4[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)CC2)c(=O)[nH]c1=O |
|
GD086210 | 3.32 | 402.49 | C23H30O6 | COc1cc(=O)oc(/C=C/C=C/C=C/C(C)=C/[C@@]2(C)O[C@H](C)[C@](C)(O)[C@H]2O)c1C |
|
GD108978 | 0.83 | 541.68 | C27H41O4N8 | CC(C)[N@@H+](CCCNC(=O)Nc1ccc(C(C)(C)C)cc1)C[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |