synthetic glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD113974 | 8.23 | 634.84 | C40H42O5S | C=CCO[C@@H]1[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)O[C@H](Sc2ccccc2)[C@H](OCC=C)[C@@H]1OCC=C |
|
GD099769 | 0.43 | 497.45 | C22H27O12N | COc1cc(C(=O)O)ccc1O[C@@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]1NC(C)=O |
|
GD107225 | 0.52 | 511.48 | C23H29O12N | COC(=O)c1ccc(O[C@@H]2O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2NC(C)=O)c(OC)c1 |
|
GD110679 | 3.06 | 599.6 | C32H29O9N3 | Cc1ccc(C(=O)OC[C@H]2O[C@@H](n3ncc(=O)[nH]c3=O)[C@H](OC(=O)c3ccc(C)cc3)[C@@H]2OC(=O)c2ccc(C)cc2)cc1 |
|
GD109139 | 2.43 | 556.53 | C29H24O8N4 | Nc1cnn([C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)n1 |
|
GD111674 | 3.85 | 607.5 | C31H31O6N2Br | Cc1ccc(C(OC[C@H]2O[C@@H](n3cc(Br)c(=O)[nH]c3=O)[C@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD109003 | 2.45 | 571.54 | C30H25O9N3 | Cc1nn([C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(=O)[nH]c1=O |
|
GD110807 | 3.09 | 528.61 | C31H32O6N2 | Cc1ccc(C(OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD110808 | 3.38 | 527.62 | C31H33O5N3 | Cc1ccc(C(OC[C@H]2O[C@@H](n3ccc(N)nc3=O)[C@H](O)[C@@H]2O)(c2ccc(C)cc2)c2ccc(C)cc2)cc1 |
|
GD110514 | 2.91 | 526.56 | C27H26O9S | Cc1ccc(S(=O)(=O)OC[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2O)cc1 |