natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD035324 | -0.46 | 332.39 | C16H28O7 | CC1(C)O[C@]2(C)CC[C@H]1CC2OC1OC(CO)C(O)C(O)C1O |
|
GD035329 | 1.88 | 478.45 | C26H22O9 | COc1cc2ccc(=O)c3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c4c5ccccc5oc1c4c23 |
|
GD035330 | 0.88 | 448.38 | C21H20O11 | COc1ccc(C=CC(=O)O[C@H](C(=O)O)[C@](O)(Cc2ccc(O)c(O)c2)C(=O)O)cc1O |
|
GD035335 | 2.68 | 862.06 | C43H75O16N | CCOC(=O)CCC(=O)OC1C(OC2C(C)C(OC3CC(C)(OC)C(O)C(C)O3)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC2(C)O)OC(C)CC1N(C)C |
|
GD035337 | 3.01 | 722.91 | C39H62O12 | CC(=O)OC[C@@]12CC[C@@]34C[C@]35CC[C@H](O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(C)(C)[C@H]5CC[C@H]4[C@@]1(C)[C@H](O)[C@H](OC(C)=O)[C@H]2[C@]1(C)CC[C@H](C(C)(C)O)O1 |
|
GD035338 | -2.9 | 534.56 | C24H38O13 | CC(=O)C=C[C@@]12O[C@H](C[C@]1(C)O[C@@H]1O[C@H](CO[C@@H]3OC[C@](O)(CO)[C@H]3O)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)C2(C)C |
|
GD035339 | 5.6 | 875.11 | C48H74O14 | CCC(C)C1OC2(CCC1C)CC1CC(CC=C(C)C(OC3CC(OC)C(OC4CC(OC)C(O)C(C)O4)C(C)O3)C(C)C=CC=C3COC4C(O)C(C)=CC(C(=O)O1)C34O)O2 |
|
GD035344 | -6.39 | 483.47 | C19H33O13N | C[C@@H]1O[C@H](O[C@@H]2[C@H](CO)O[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1N[C@@H]1C=C(CO)[C@H](O)[C@H](O)[C@H]1O |
|
GD035357 | 0.77 | 488.45 | C24H24O11 | CC(=O)OC[C@@H]1O[C@H](Oc2ccc3c(c2)OC[C@@H]2c4cc5c(cc4O[C@H]32)OCO5)[C@H](O)[C@H](O)[C@H]1O |
|
GD035359 | 6.24 | 590.89 | C36H62O6 | CC[C@H](CC[C@H](C)[C@@H]1CC[C@@H]2[C@]3(C)CC=C4C[C@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O)CC[C@@]4(C)[C@H]3CC[C@]12C)C(C)C |