synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD112590 | 4.33 | 613.75 | C34H47O9N | CC(/C=C/C=C/C=C/C=C/C=C/C(O)=C1/C(=O)[C@H](CCC(=O)O)N(C)C1=O)=C\[C@H](C)[C@@H](O[C@H]1C[C@@H](O)[C@@H](O)[C@@H](C)O1)C(C)C |
|
|
GD112590 | 4.33 | 613.75 | C34H47O9N | CC(/C=C/C=C/C=C/C=C/C=C/C(O)=C1/C(=O)[C@H](CCC(=O)O)N(C)C1=O)=C\[C@H](C)[C@@H](O[C@H]1C[C@@H](O)[C@@H](O)[C@@H](C)O1)C(C)C |
|
GD093093 | 1.06 | 448.47 | C23H28O9 | COc1cc(/C=C\c2ccc(OC)c(OC)c2)cc(O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1 |
|
GD093092 | 1.06 | 448.47 | C23H28O9 | COc1cc(/C=C\c2ccc(OC)c(OC)c2)cc(O[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1 |
|
GD103740 | 0.03 | 496.47 | C21H28O10N4 | COc1nc(N[C@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD103741 | 0.03 | 496.47 | C21H28O10N4 | COc1nc(N[C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(/C)C(C)=O)c(=O)n1C |
|
GD107635 | 0.67 | 570.58 | C23H30O11N4S | CSc1nc(N[C@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)[nH]1 |
|
GD107636 | 0.67 | 570.58 | C23H30O11N4S | CSc1nc(N[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)[nH]1 |
|
GD103685 | 0.74 | 498.51 | C20H26O9N4S | CSc1nc(N[C@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)[nH]1 |
|
GD103684 | 0.74 | 498.51 | C20H26O9N4S | CSc1nc(N[C@@H]2OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]2OC(C)=O)c(/N=C(\C)C(C)=O)c(=O)[nH]1 |