synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113194 | 7.44 | 584.78 | C36H40O5S | CCS[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |
|
GD099760 | 0.73 | 463.48 | C23H29O9N | CCc1cccc2c3c([nH]c12)[C@](CC)(CC(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)OCC3 |
|
GD099759 | 0.73 | 463.48 | C23H29O9N | CCc1cccc2c3c([nH]c12)[C@@](CC)(CC(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)OCC3 |
|
GD109863 | 2.8 | 585.56 | C30H29O9NF2 | O=C(O)[C@H]1O[C@@H](O[C@@H](CC[C@H]2C(=O)N(c3ccc(F)cc3)[C@@H]2c2ccc(O)cc2)c2ccc(F)cc2)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD104587 | 1.07 | 492.51 | C22H24O9N2S | Cc1nc(-c2ccc(OCC(C)C)c(C#N)c2)sc1C(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O |
|
GD104200 | 1.01 | 496.9 | C24H25O10Cl | CC(C)(Oc1ccc([C@H](O)c2ccc(Cl)cc2)cc1)C(=O)O[C@H]1O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD104199 | 1.01 | 496.9 | C24H25O10Cl | CC(C)(Oc1ccc([C@@H](O)c2ccc(Cl)cc2)cc1)C(=O)O[C@H]1O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD093591 | -1.35 | 482.4 | C19H20O7N6F2 | O=C(O)[C@H]1O[C@@H](OC(Cn2cncn2)(Cn2cncn2)c2ccc(F)cc2F)[C@H](O)[C@@H](O)[C@@H]1O |
|
GD106580 | -1.24 | 521.54 | C25H33O10N2 | COc1ccc(C[C@@H](C)[NH2+]C[C@H](O)c2ccc(O[C@@H]3O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]3O)c(NC=O)c2)cc1 |
|
GD107816 | 1.65 | 656.64 | C32H36O13N2 | CC(=O)N[C@H]1[C@@H](OC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |