SMIRKS
[O:1]=[O:2].[O:3]([C:4]1:[C:5]([H:19]):[C:6]([H:20]):[C:7]([H:21]):[C:8]([C:9]([C:10]([C:11]2:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:2[H:26])([H:27])[H:28])([H:29])[H:30]):[C:17]:1[O:18][H:31])[H:32]>>[O:1]=[C:8]([C:7](=[C:6]([C:5](=[C:4]([O:3][H:32])[C:17](=[O:2])[O:18][H:31])[H:19])[H:20])[H:21])[C:9]([C:10]([C:11]1:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:1[H:26])([H:27])[H:28])([H:29])[H:30]
Source Database Data
| Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
|---|---|---|---|---|---|---|
| 39544 | 3-phenethylcatechol + O2 = 2-hydroxy-6-oxo-8-phenylocta-2,4-dienoate | False | Escherichia coli | P0ABR9 | swissprot | 1.13.11.16 |
Derived Partial Reactions
EVODEX.1-P233
:[C:6]([H:20]):[C:7]([H:21]):[C:8]([C:9]([C:10]([C:11]2:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:2[H:26])([H:27])[H:28])([H:29])[H:30]):[C:17]:1[O:18][H:31])[H:32]>>O=[C:8]([C:7](=[C:6]([C:5](=[C:4]([O:3][H:32])[C:17](=O)[O:18][H:31])[H:19])[H:20])[H:21])[C:9]([C:10]([C:11]1:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:1[H:26])([H:27])[H:28])([H:29])[H:30]](../images/EVODEX.1-P233.svg)
[O:3]([C:4]1:[C:5]([H:19]):[C:6]([H:20]):[C:7]([H:21]):[C:8]([C:9]([C:10]([C:11]2:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:2[H:26])([H:27])[H:28])([H:29])[H:30]):[C:17]:1[O:18][H:31])[H:32]>>O=[C:8]([C:7](=[C:6]([C:5](=[C:4]([O:3][H:32])[C:17](=O)[O:18][H:31])[H:19])[H:20])[H:21])[C:9]([C:10]([C:11]1:[C:12]([H:22]):[C:13]([H:23]):[C:14]([H:24]):[C:15]([H:25]):[C:16]:1[H:26])([H:27])[H:28])([H:29])[H:30]