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EVODEX.1-R6565

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
266439 phenylpropionitrile + 2 H2O = phenylpropionic acid + NH3 False Brassica napus nan 3.5.5.1

Derived Partial Reactions

EVODEX.1-P5891

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

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