synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD093419 | -6.69 | 479.62 | C21H45O7N5 | CC[NH2+][C@@H]1C[C@H](N)[C@@H](O[C@@H]2OC(C[NH3+])=CC[C@@H]2[NH3+])[C@H](O)[C@H]1O[C@H]1OC[C@](C)(O)[C@H]([NH2+]C)[C@H]1O |
|
GD107454 | 0.56 | 544.52 | C25H28O10N4 | CC(=O)OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(C)c(C)cc21)OC(C)=O |
|
GD107455 | 0.56 | 544.52 | C25H28O10N4 | CC(=O)OC[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H](Cn1c2nc(=O)[nH]c(=O)c-2nc2cc(C)c(C)cc21)OC(C)=O |
|
GD040971 | -1.93 | 164.16 | C6H12O5 | CO[C@@H]1OC[C@H](O)[C@@H](O)[C@H]1O |
|
GD110574 | 2.93 | 560.68 | C31H44O9 | CO[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O[C@H]2CC[C@@]3(C=O)[C@@H](CC[C@@H]4[C@H]3CC[C@]3(C)[C@@H](c5ccc(=O)oc5)CC[C@]43O)C2)[C@H]1O |
|
GD105830 | -5.15 | 529.23 | C10H22O14N5P3 | NC1=NC(=O)[C@@H]2N=CN([C@@H]3O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)[C@H]2N1 |
|
GD105829 | -5.15 | 529.23 | C10H22O14N5P3 | NC1=NC(=O)[C@@H]2N=CN([C@@H]3O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)[C@@H]2N1 |
|
GD043292 | -2.82 | 253.28 | C8H15O6NS | O=C(O)[C@@H]1CS[C@@H]([C@H](O)[C@@H](O)[C@H](O)CO)N1 |
|
GD062419 | -2.25 | 370.1 | C9H11O6N2I | O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)cc1I |
|
GD042796 | -1.17 | 284.25 | C11H13O4N4F | Nc1nc(F)nc2c([C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)c[nH]c12 |