EVODEX Logo

EVODEX.1-R6599

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
267083 2-pentenenitrile + H2O = 2-pentenoic acid + NH3 False Rhodococcus rhodochrous nan 3.5.5.7

Derived Partial Reactions

EVODEX.1-P5953

[C:1]([C:2]([C:3](=[C:4]([C:5]#[N:6])[H:9])[H:10])([H:11])[H:12])([H:13])([H:14])[H:15].[H][O:7][H]>>[H]O[C:5]([C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9])=[O:7].[H][N:6]([H])[H]

[C:1]([C:2]([C:3](=[C:4]([C:5]#[N:6])[H:9])[H:10])([H:11])[H:12])([H:13])([H:14])[H:15].[H][O:7][H]>>[H]O[C:5]([C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9])=[O:7].[H][N:6]([H])[H]

EVODEX.1-P5954

N#[C:5][C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9]>>[H]O[C:5](=O)[C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9]

N#[C:5][C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9]>>[H]O[C:5](=O)[C:4](=[C:3]([C:2]([C:1]([H:13])([H:14])[H:15])([H:11])[H:12])[H:10])[H:9]