| 名称 | 内容 |
|---|---|
| kegg编号 | C02927 |
| pubchemid | 5849 |
| name | 2-Caffeoylisocitrate |
| formula | C15H14O10 |
| structure |  |
| Isomeric_Smiles | C[N+]1(CCCC1)CCCCC[N+]2(CCCC2)C.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O.[C@@H]([C@H](C(=O)[O-])O)(C(=O)O)O |
| Cannoical_Smiles | C[N+]1(CCCC1)CCCCC[N+]2(CCCC2)C.C(C(C(=O)[O-])O)(C(=O)O)O.C(C(C(=O)[O-])O)(C(=O)O)O |
| Gotenzyme_Smiles | O=C(O)CC(C(=O)O)C(OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O |
