SMIRKS
[H][C:2]([C:1]([H:21])([H:22])[H:23])([C:3]([H:16])([H:17])[H:18])[O:4][H].[O:5]=[C:6]([C:7]([F:8])([H:24])[H:25])[C:9]1:[C:10]([H:26]):[C:11]([H:27]):[C:12]([F:13]):[C:14]([H:28]):[C:15]:1[H:29]>>[C:1]([C:2]([C:3]([H:16])([H:17])[H:18])=[O:4])([H:21])([H:22])[H:23].[H][O:5][C@@:6]([H])([C:7]([F:8])([H:24])[H:25])[C:9]1:[C:10]([H:26]):[C:11]([H:27]):[C:12]([F:13]):[C:14]([H:28]):[C:15]:1[H:29]
Source Database Data
| Rxn Index | Original Reaction Text | Natural | Organism | Protein Refs | Protein DB | EC Number |
|---|---|---|---|---|---|---|
| 402 | 2-fluoro-1-(4-fluorophenyl)ethanone + propan-2-ol = (1R)-2-fluoro-1-(4-fluorophenyl)ethanol + acetone | False | Rhodococcus ruber | Q8KLT9 | uniprot | 1.1.1.1 |
Derived Partial Reactions
EVODEX.1-P17
![[H][C:2]([C:1]([H:21])([H:22])[H:23])([C:3]([H:16])([H:17])[H:18])[O:4][H].[O:5]=[C:6]([C:7]([F:8])([H:24])[H:25])[C:9]1:[C:10]([H:26]):[C:11]([H:27]):[C:12]([F:13]):[C:14]([H:28]):[C:15]:1[H:29]>>[C:1]([C:2]([C:3]([H:16])([H:17])[H:18])=[O:4])([H:21])([H:22])[H:23].[H][O:5][C@@:6]([H])([C:7]([F:8])([H:24])[H:25])[C:9]1:[C:10]([H:26]):[C:11]([H:27]):[C:12]([F:13]):[C:14]([H:28]):[C:15]:1[H:29]](../images/EVODEX.1-P17.svg)
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