natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD107754 | 0.75 | 550.65 | C29H42O10 | C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[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 |
|
GD107755 | 0.75 | 550.65 | C29H42O10 | C[C@@H]1O[C@@H](O[C@H]2CC[C@]3(C=O)[C@H]4CC[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 |
|
GD107756 | 0.75 | 550.65 | C29H42O10 | C[C@@H]1O[C@@H](O[C@@H]2CC[C@]3(C=O)[C@@H]4CC[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 |
|
GD107757 | 0.75 | 550.65 | C29H42O10 | C[C@@H]1O[C@@H](O[C@@H]2CC[C@]3(C=O)[C@@H]4CC[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 |
|
GD107758 | 0.48 | 578.61 | C29H38O12 | C=C[C@H]1[C@H](C[C@@H]2CC(=O)C[C@H](CCc3ccc(O)cc3)O2)C(C(=O)OC)=CO[C@@H]1O[C@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]1O |
|
GD107759 | 0.48 | 578.61 | C29H38O12 | C=C[C@H]1[C@H](O[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1C[C@@H]1CC(=O)C[C@H](CCc2ccc(O)cc2)O1 |
|
GD107766 | 0.82 | 562.66 | C30H42O10 | CC(=O)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C |
|
GD107768 | 0.75 | 520.44 | C24H24O13 | CC(=O)OC[C@H]1O[C@@H](OC2=CC(=O)c3cccc(O)c3C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107769 | 0.75 | 520.44 | C24H24O13 | CC(=O)OC[C@H]1O[C@@H](OC2=CC(=O)c3c(O)cccc3C2=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD107770 | 0.75 | 550.65 | C29H42O10 | C[C@@H]1O[C@@H](O[C@@H]2CC[C@]3(C=O)[C@H]4CC[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 |