| 名称 | 内容 |
|---|---|
| kegg编号 | C20327 |
| pubchemid | 163312065 |
| name | 2-Oxo-4-phenylbutyric acid |
| formula | C10H10O3 |
| structure |  |
| Isomeric_Smiles | COC1=C2C=C(C=C1)C(=O)N[C@H]3CN(C[C@@H]3OC4=C(C=C(CNC(=O)CO2)C=C4)OC)C(=O)CC5=CC=NC=C5 |
| Cannoical_Smiles | COC1=C2C=C(C=C1)C(=O)NC3CN(CC3OC4=C(C=C(CNC(=O)CO2)C=C4)OC)C(=O)CC5=CC=NC=C5 |
| Gotenzyme_Smiles | O=C(O)C(=O)CCc1ccccc1 |
