synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110022 | 2.6 | 522.35 | C22H16O8F6 | O=C(COC(=O)[C@H](O)[C@@H](O)C(=O)OCC(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
|
GD110021 | 2.6 | 522.35 | C22H16O8F6 | O=C(COC(=O)[C@@H](O)[C@H](O)C(=O)OCC(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
|
GD110020 | 2.6 | 522.35 | C22H16O8F6 | O=C(COC(=O)[C@@H](O)[C@@H](O)C(=O)OCC(=O)c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1 |
|
GD111239 | 3.05 | 570.55 | C31H26O9N2 | Cc1cn([C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O |
|
GD052712 | -2.5 | 347.22 | C10H14O7N5P | Nc1nc2c(ncn2[C@@H]2O[C@H](CP(=O)(O)O)[C@@H](O)[C@@H]2O)c(=O)[nH]1 |
|
GD005742 | 3.63 | 612.63 | C31H36O11N2 | CO[C@@H]1[C@H](OC(N)=O)[C@H](O)[C@H](Oc2ccc3c(O)c(NC(=O)c4ccc(O)c(CC=C(C)C)c4)c(=O)oc3c2C)OC1(C)C |
|
GD108483 | 1.82 | 600.54 | C30H24O10N4 | O=C(OC[C@@H]1O[C@@](O)(COC(=O)c2cccnc2)[C@H](OC(=O)c2cccnc2)[C@H]1OC(=O)c1cccnc1)c1cccnc1 |
|
GD105929 | -4.69 | 563.35 | C15H27O14N5P2 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO[PH](O)(O)O[PH](O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O |
|
GD105779 | -1.95 | 537.54 | C24H27O6N9 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)N2CCN(CC(=O)Nc3cccc4c3CNC4=O)CC2)[C@@H](O)[C@H]1O |
|
GD062644 | -1.56 | 367.32 | C14H17O7N5 | Nc1ncnc2c1ncn2[C@@H]1O[C@H](COC(=O)CCC(=O)O)[C@@H](O)[C@@H]1O |