| 名称 | 内容 |
|---|---|
| kegg编号 | C00891 |
| pubchemid | 4147 |
| name | Pregnan-21-al |
| formula | C21H34O |
| structure |  |
| Isomeric_Smiles | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCCC=CC=CC(=O)NO |
| Cannoical_Smiles | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CCCC=CC=CC(=O)NO |
| Gotenzyme_Smiles | C[C@]12CCCC[C@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@H]2CC=O |
