synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD086311 | -7.74 | 452.57 | C19H42O7N5 | C[NH2+][C@@H]1[C@H](O)[C@H](O[C@@H]2[C@H]([NH3+])C[C@H]([NH3+])[C@H](O[C@@H]3OC(C[NH3+])=CC[C@@H]3[NH3+])[C@H]2O)OC[C@]1(C)O |
|
GD086312 | -7.74 | 452.57 | C19H42O7N5 | C[NH2+][C@@H]1[C@H](O)[C@H](O[C@H]2[C@@H](O)[C@@H](O[C@@H]3OC(C[NH3+])=CC[C@@H]3[NH3+])[C@@H]([NH3+])C[C@H]2[NH3+])OC[C@]1(C)O |
|
GD092729 | 0.77 | 446.41 | C22H22O10 | COc1ccc(Oc2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]4O)ccc3c2=O)cc1 |
|
GD092728 | 0.77 | 446.41 | C22H22O10 | COc1ccc(Oc2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@@H]4O)ccc3c2=O)cc1 |
|
GD092730 | 0.77 | 446.41 | C22H22O10 | COc1ccc(Oc2coc3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1 |
|
GD095785 | -0.42 | 560.52 | C27H24O8N6 | O=C(Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1)[C@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O |
|
GD095787 | -0.42 | 560.52 | C27H24O8N6 | O=C(Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O |
|
GD095788 | -0.42 | 560.52 | C27H24O8N6 | O=C(Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1)[C@@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O |
|
GD095786 | -0.42 | 560.52 | C27H24O8N6 | O=C(Nc1nc2c(ncn2[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)c(=O)[nH]1)[C@H](Cc1ccccc1)N1C(=O)c2ccccc2C1=O |
|
GD099822 | 0.41 | 458.42 | C23H22O10 | O=c1c(-c2ccc3c(c2)OCCO3)coc2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)ccc12 |