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EVODEX.1-R6779

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
280108 4-fluoro-benzaldehyde + acetaldehyde = (S)-1-(4-fluoro-phenyl)-2-hydroxy-propan-1-one False Pseudomonas putida nan 4.1.1.7

Derived Partial Reactions

EVODEX.1-P6172

[H][C:5](=[O:4])[C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]([F:10]):[C:11]([H:19]):[C:12]:1[H:20]>>[H]O[C@@]([H])(C([H])([H])[H])[C:5](=[O:4])[C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]([F:10]):[C:11]([H:19]):[C:12]:1[H:20]

[H][C:5](=[O:4])[C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]([F:10]):[C:11]([H:19]):[C:12]:1[H:20]>>[H]O[C@@]([H])(C([H])([H])[H])[C:5](=[O:4])[C:6]1:[C:7]([H:17]):[C:8]([H:18]):[C:9]([F:10]):[C:11]([H:19]):[C:12]:1[H:20]