natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD111263 | 3.12 | 620.82 | C35H56O9 | C[C@@H]1C[C@H]2O[C@@]3(O[C@@H]2C(C)(C)O)[C@H](O)[C@@]2(C)[C@@H]4CC[C@H]5C(C)(C)[C@@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)CC[C@@]56C[C@@]46CC[C@]2(C)[C@@H]13 |
|
GD111264 | 3.25 | 534.69 | C30H46O8 | CO[C@H]1C[C@H](O[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)CC[C@]5(O)[C@@H]4CC[C@]3(O)C2)O[C@H](C)[C@H]1O |
|
GD111268 | 3.3 | 633.65 | C34H35O11N | CC(=O)OC[C@H]1O[C@@H](OC(=O)Cc2ccccc2)[C@@H](NC(=O)c2ccc(OCc3ccccc3)cc2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111269 | 3.3 | 633.65 | C34H35O11N | CC(=O)OC[C@@H]1O[C@@H](OC(=O)Cc2ccccc2)[C@@H](NC(=O)c2ccc(OCc3ccccc3)cc2)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111270 | 3.3 | 633.65 | C34H35O11N | CC(=O)OC[C@H]1O[C@@H](OC(=O)Cc2ccccc2)[C@@H](NC(=O)c2ccc(OCc3ccccc3)cc2)[C@@H](OC(C)=O)[C@H]1OC(C)=O |
|
GD111271 | 3.3 | 633.65 | C34H35O11N | CC(=O)OC[C@@H]1O[C@@H](OC(=O)Cc2ccccc2)[C@@H](NC(=O)c2ccc(OCc3ccccc3)cc2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |
|
GD111280 | 3.11 | 524.56 | C26H36O11 | CCCCCCOc1ccc(O[C@@H]2O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H]2OC(C)=O)cc1 |
|
GD111285 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O[C@H]2CC[C@]34C[C@]35CC[C@]3(C)[C@@H]([C@]6(C)CC[C@H](C(C)(C)O)O6)[C@@H](O)C[C@@]3(C)[C@@H]5C[C@H](O)[C@H]4C2(C)C)OC[C@@H](O)[C@@H]1O |
|
GD111286 | 3.47 | 664.88 | C37H60O10 | CC(=O)O[C@H]1[C@H](O)[C@H]([C@]2(C)CC[C@H](C(C)(C)O)O2)[C@@]2(C)CC[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@]12C |
|
GD111287 | 3.06 | 576.94 | C28H25O12Cl | CC(=O)OC[C@@H]1O[C@@H](Oc2cc3oc(=O)c4ccccc4c3cc2Cl)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O |