natural glycosides
| Molecular_Structure | GD id | AlogP | MolWeight | MolFormula | Smiles |
|---|---|---|---|---|---|
|
GD110579 | 2.76 | 545.67 | C30H43O8N | CO[C@H]1C[C@H](O[C@@H]2CC[C@]3(C#N)[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 |
|
GD110580 | 2.76 | 545.67 | C30H43O8N | CO[C@H]1C[C@H](O[C@@H]2CC[C@]3(C#N)[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 |
|
GD110581 | 2.76 | 545.67 | C30H43O8N | CO[C@H]1C[C@H](O[C@@H]2CC[C@]3(C#N)[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 |
|
GD110594 | 2.84 | 573.73 | C32H47O8N | C=CC/N=C/[C@]12CC[C@@H](O[C@H]3C[C@@H](O)[C@@H](O)[C@H](C)O3)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O |
|
GD110595 | 2.84 | 573.73 | C32H47O8N | C=CC/N=C/[C@]12CC[C@@H](O[C@H]3C[C@@H](O)[C@@H](O)[C@@H](C)O3)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O |
|
GD110596 | 2.84 | 573.73 | C32H47O8N | C=CC/N=C/[C@]12CC[C@@H](O[C@H]3C[C@@H](O)[C@H](O)[C@@H](C)O3)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O |
|
GD110597 | 2.84 | 573.73 | C32H47O8N | C=CC/N=C/[C@]12CC[C@@H](O[C@H]3C[C@@H](O)[C@H](O)[C@H](C)O3)C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](C3=CC(=O)OC3)CC[C@@]12O |
|
GD110598 | 2.92 | 618.72 | C33H46O11 | CC(=O)O[C@H]1[C@H](C)O[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[C@H]1OC(C)=O |
|
GD110599 | 2.92 | 618.72 | C33H46O11 | CC(=O)O[C@@H]1C[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)O[C@H](C)[C@H]1OC(C)=O |
|
GD110600 | 2.92 | 618.72 | C33H46O11 | CC(=O)O[C@@H]1C[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)O[C@@H](C)[C@H]1OC(C)=O |