| 名称 | 内容 |
|---|---|
| kegg编号 | C19263 |
| pubchemid | 124489935 |
| name | Methyl isobutyl ketone |
| formula | C6H12O |
| structure |  |
| Isomeric_Smiles | C[C@H](CCC(=O)O)[C@@H]1CC[C@@H]2[C@]1(CC[C@H]3[C@@H]2CC[C@H]4[C@]3(CC[C@H](C4)O)C)C |
| Cannoical_Smiles | CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C |
| Gotenzyme_Smiles | CC(=O)CC(C)C |
