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EVODEX.1-R6577

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
266645 phenylbutyronitrile + H2O = phenylbutyric acid + NH3 False Arabidopsis thaliana P32961 swissprot 3.5.5.1

Derived Partial Reactions

EVODEX.1-P5911

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

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