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EVODEX.1-R1915

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[O:10]=[C:11]([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23].[H][O:9][C:7]([C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6])=[O:8]>>[C:7](=[O:8])=[O:9].[H][O:10][C:11]([C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6])([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
109877 2-fluorobenzaldehyde + oxaloacetate = (1R)-1-(2-fluorophenyl)-1-hydroxypropan-2-one + 2 CO2 False Escherichia coli K-12 nan 2.2.1.9

Derived Partial Reactions

EVODEX.1-P1404

[O:10]=[C:11]([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23].[H]OC(=O)[C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6]>>[H][O:10][C:11]([C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6])([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23]

[O:10]=[C:11]([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23].[H]OC(=O)[C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6]>>[H][O:10][C:11]([C:5]([C:4]([C:2](=[O:1])[O:3][H:24])([H:26])[H:27])=[O:6])([C:12]1:[C:13]([H:19]):[C:14]([H:20]):[C:15]([H:21]):[C:16]([H:22]):[C:17]:1[F:18])[H:23]