natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD032512 | 0.58 | 478.49 | C24H30O10 | COc1ccc(CCc2c(O)ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c2C(C)=O)cc1OC |
|
GD032531 | -3.38 | 180.16 | C6H12O6 | O=C(CO)[C@H](O)[C@H](O)[C@H](O)CO |
|
GD032536 | 3.65 | 738.96 | C40H66O12 | CC(=O)OCC1OC(O[C@@H]2C[C@@H]3C(C)(C)[C@H](OC(C)=O)CC[C@@]3(C)[C@@H]3CC[C@@H]4[C@@]5(CC[C@@]4(C)[C@@]32C)O[C@H]([C@H](O)C(C)(C)O)C[C@H]5C)C(O)C(O)C1O |
|
GD032544 | 1.5 | 526.49 | C27H26O11 | O=C(O[C@@H]1[C@H](Oc2ccc(O)cc2COC(=O)c2ccccc2O)O[C@H](CO)[C@H](O)[C@H]1O)c1ccccc1 |
|
GD032545 | 0.35 | 476.44 | C22H24O10N2 | O=C(OC[C@H](O)[C@H](O)COC(=O)C(Cc1ccc(O)cc1)=NO)C(Cc1ccc(O)cc1)=NO |
|
GD032559 | 0.23 | 532.45 | C25H24O13 | O=C(O)CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(c2)OCC2c4cc5c(cc4OC32)OCO5)[C@H](O)[C@H](O)[C@H]1O |
|
GD032562 | 3.11 | 534.69 | C30H46O8 | COC1C(O)C(C)O[C@H](OC2CC[C@]3(C)C4CC[C@]5(C)C(C6=CC(=O)OC6)CC[C@@]5(O)C4CC[C@H]3C2)C1O |
|
GD032564 | -2.71 | 626.52 | C27H30O17 | O=c1c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12 |
|
GD032567 | 1.44 | 740.93 | C39H64O13 | C[C@H]1CC[C@@]2(OC1)O[C@H]1C[C@@H]3[C@@H]4CC[C@@H]5C[C@H](O[C@@H]6O[C@H](CO)[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H]6O)CC[C@@]5(C)[C@H]4CC[C@@]3(C)[C@@H]1[C@H]2C |
|
GD032574 | 4.67 | 604.83 | C35H56O8 | CC1(C)[C@@H](O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)CC[C@]2(C)[C@@H]1CC[C@]1(C)[C@@H]2CC=C2[C@H]3[C@@H](O)C(C)(C)CC[C@]3(C(=O)O)CC[C@]21C |