| 名称 | 内容 |
|---|---|
| kegg编号 | C08862 |
| pubchemid | 11055 |
| name | Digitalin |
| formula | C36H56O14 |
| structure |  |
| Isomeric_Smiles | C1=CC=C(C=C1)C2=CC(=O)C3=C(C=CC(=C3O2)O)O |
| Cannoical_Smiles | C1=CC=C(C=C1)C2=CC(=O)C3=C(C=CC(=C3O2)O)O |
| Gotenzyme_Smiles | CO[C@H]1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O[C@@H](O[C@H]2CC[C@]3(C)[C@H]4CC[C@]5(C)[C@@H](C6=CC(=O)OC6)[C@@H](O)C[C@]5(O)[C@@H]4CC[C@@H]3C2)[C@@H]1O |
