natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD037972 | -3.14 | 259.15 | C6H14O8NP | N[C@H]1[C@@H](O)O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O |
|
GD038005 | -3.33 | 477.6 | C21H43O7N5 | CN[C@H](C)[C@@H]1CC[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@@H](O[C@H]3OC[C@@](C)(O)[C@H](NC)[C@@H]3O)[C@H]2O)O1 |
|
GD038019 | -1.13 | 256.25 | C12H16O6 | OC[C@H]1O[C@H](Oc2ccccc2)[C@@H](O)[C@@H](O)[C@H]1O |
|
GD038028 | -0.95 | 251.25 | C10H13O3N5 | C[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O |
|
GD038048 | -1.4 | 667.14 | C10H18O19N5P5 | Nc1ncnc2c1ncn2[C@H]1O[C@H](CO[P@](=O)(O)O[P@](=O)(O)O[P@](=O)(O)O[P@](=O)(O)OP(=O)(O)O)[C@H](O)[C@@H]1O |
|
GD038049 | -1.0 | 269.24 | C10H12O3N5F | Nc1ncnc2c1ncn2[C@H]1O[C@H](CF)[C@H](O)[C@@H]1O |
|
GD038053 | -5.57 | 422.36 | C12H22O14S | O=S(=O)(O)O[C@@H]1[C@H](O)[C@@H](CO)O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O)[C@@H](O)[C@H]2O)[C@@H]1O |
|
GD038058 | 0.26 | 376.15 | C11H13O3N4I | C[C@H]1O[C@H](n2cc(I)c3c(N)ncnc32)[C@H](O)[C@@H]1O |
|
GD038083 | 0.84 | 699.71 | C35H41O14N | COC(=O)[C@H]1c2cc3c(c(O)c2[C@H](O[C@@H]2C[C@H](O)[C@H](O)[C@@H](C)O2)C[C@]1(C)O)C(=O)c1c(O)cc2c(c1C3=O)O[C@@H]1C[C@@H](N(C)C)[C@@H](O)[C@@]2(C)O1 |
|
GD038096 | -1.83 | 370.39 | C13H18O5N6S | Nc1ncnc2c1ncn2[C@H]1O[C@H](CSC[C@@H](N)C(=O)O)[C@H](O)[C@@H]1O |