| 名称 | 内容 |
|---|---|
| kegg编号 | C17114 |
| pubchemid | 135626081 |
| name | Spirolaurenone |
| formula | C15H23BrO |
| structure |  |
| Isomeric_Smiles | CC1=NN(C(=C1C#N)N=NC2=C(NN3C2=NC(=N3)CCCOC4=CC=C(C=C4)[N+](=O)[O-])C(C)(C)C)C5=CC=CC=C5S(=O)(=O)O |
| Cannoical_Smiles | CC1=NN(C(=C1C#N)N=NC2=C(NN3C2=NC(=N3)CCCOC4=CC=C(C=C4)[N+](=O)[O-])C(C)(C)C)C5=CC=CC=C5S(=O)(=O)O |
| Gotenzyme_Smiles | CC(=O)[C@@H]1CC[C@]2(C1)C(C)=CC[C@@H](Br)C2(C)C |
