synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD107311 | 0.67 | 520.49 | C25H28O12 | COc1ccc(OC)c(-c2cc(=O)c3c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc(OC)c(OC)c3o2)c1 |
|
GD062282 | 1.93 | 346.46 | C18H34O6 | CCCCCCCCCCCC(=O)OC[C@H](O)[C@H]1OC[C@H](O)[C@H]1O |
|
GD106254 | -2.53 | 531.42 | C16H33O10N6P2 | [NH3+]CCCCCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O)[C@@H](O)[C@H]1O[PH](O)(O)O |
|
GD105619 | -4.41 | 544.26 | C11H25O14N5P3 | C[n+]1cn([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c2c1[C@H](O)N=C(N)N2 |
|
GD105620 | -4.41 | 544.26 | C11H25O14N5P3 | C[n+]1cn([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c2c1[C@@H](O)N=C(N)N2 |
|
GD109006 | 2.13 | 548.34 | C24H22O9NBr | COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O |
|
GD110003 | 2.74 | 556.53 | C30H24O9N2 | O=C(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD110004 | 2.74 | 556.53 | C30H24O9N2 | O=C(OC[C@@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1)c1ccccc1 |
|
GD105684 | -4.1 | 669.48 | C21H33O14N7P2 | NC(=O)C1=CN([C@@H]2O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@@H]3O[C@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@H](O)[C@@H]2O)C=CC1 |
|
GD085393 | -0.46 | 412.5 | C21H34O7N | C/C=C(\C)C(=O)O[C@H]1CC[N@@H+]2CC=C(COC(=O)[C@@](O)([C@@H](C)OC)C(C)(C)O)[C@H]12 |