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EVODEX.1-R6571

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2](=[C:3]([C:4]#[N:5])[H:8])[H:9])([H:10])([H:11])[H:12].[H][O:6][H].[H][O:7][H:15]>>[C:1]([C:2](=[C:3]([C:4](=[O:6])[O:7][H:15])[H:8])[H:9])([H:10])([H:11])[H:12].[H][N:5]([H])[H]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
266541 crotononitrile + 2 H2O = crotonic acid + NH3 False Aeribacillus pallidus nan 3.5.5.1

Derived Partial Reactions

EVODEX.1-P5898

N#[C:4][C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8].[H][O:6][H]>>[H]O[C:4]([C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8])=[O:6]

N#[C:4][C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8].[H][O:6][H]>>[H]O[C:4]([C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8])=[O:6]

EVODEX.1-P5899

N#[C:4][C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8]>>[H]O[C:4](=O)[C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8]

N#[C:4][C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8]>>[H]O[C:4](=O)[C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8]

EVODEX.1-P5900

[C:1]([C:2](=[C:3]([C:4]#[N:5])[H:8])[H:9])([H:10])([H:11])[H:12]>>[H]O[C:4](=O)[C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8].[H][N:5]([H])[H]

[C:1]([C:2](=[C:3]([C:4]#[N:5])[H:8])[H:9])([H:10])([H:11])[H:12]>>[H]O[C:4](=O)[C:3](=[C:2]([C:1]([H:10])([H:11])[H:12])[H:9])[H:8].[H][N:5]([H])[H]