natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD008661 | -0.56 | 474.42 | C23H22O11 | COc1cc(O)c2c(c1)C(=O)c1cc(C)c(C(=O)OC[C@@H]3O[C@H](O)[C@H](O)[C@H](O)[C@H]3O)cc1C2=O |
|
GD008664 | 2.17 | 578.7 | C31H46O10 | CO[C@@H]1C=CC=CCCC[C@H](C)OC(=O)C=CC=CC[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)C=CC=CC[C@H](O)C1 |
|
GD008685 | -0.39 | 582.64 | C29H42O12 | C[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C(=O)O)[C@@H]4C[C@H](O)[C@]5(C)[C@H](C6=CC(=O)OC6)CC[C@@]5(O)[C@H]4CC[C@@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O |
|
GD008689 | -2.14 | 402.35 | C17H22O11 | COC(=O)C1=CC[C@@H]2C(C(=O)O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]12 |
|
GD008694 | 4.03 | 634.85 | C36H58O9 | CC1(C)CC[C@@]2(C(=O)O)[C@H](O)C[C@@]3(C)C(=CC[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]2C1 |
|
GD008704 | 0.33 | 520.44 | C24H24O13 | COc1cc2oc(-c3ccc(O)c(O)c3)cc(=O)c2c(O)c1O[C@@H]1O[C@H](COC(C)=O)[C@H](O)[C@H](O)[C@H]1O |
|
GD008705 | -0.25 | 929.11 | C47H76O18 | C[C@@H]1CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)C(C)(C)[C@H]5CC[C@]43C)[C@H]2[C@]1(C)O |
|
GD008722 | -0.28 | 566.64 | C29H42O11 | C[C@@H]1O[C@H](O[C@@H]2CC[C@]3(C=O)[C@@H]4C[C@H](O)[C@]5(C)[C@H](C6=CC(=O)OC6)CC[C@@]5(O)[C@H]4CC[C@@]3(O)C2)[C@H](O)[C@H](O)[C@H]1O |
|
GD008723 | -2.85 | 814.79 | C37H50O20 | COc1cc(C=CC(=O)O[C@@H]2[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)O[C@H](OCCc3ccc(O)c(O)c3)[C@H](O)[C@H]2OC[C@@H]2O[C@H](C)[C@H](O)[C@H](O)[C@H]2O)ccc1O |
|
GD008726 | 1.44 | 740.93 | C39H64O13 | CC1CC[C@]2(OC1)OC1C[C@@H]3[C@@H]4CC[C@@H]5CC(OC6OC(CO)C(OC7OC(CO)C(O)C(O)C7O)C(O)C6O)CCC5(C)[C@H]4CCC3(C)C1[C@H]2C |