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EVODEX.1-R6507

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]([C:3](=[O:4])[O:5][H:14])([H:15])[H:16])([H:17])([H:18])[H:19].[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[C:1]([C:2]([C:3](=[O:4])[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27])([H:15])[H:16])([H:17])([H:18])[H:19].[H][O:5][H:14]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
259140 N-benzylpropionamide + H2O = propionate + benzylamine {r} False Arthrobacter pascens nan 3.5.1.91

Derived Partial Reactions

EVODEX.1-P5815

[H]O[C:3]([C:2]([C:1]([H:17])([H:18])[H:19])([H:15])[H:16])=[O:4].[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[C:1]([C:2]([C:3](=[O:4])[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27])([H:15])[H:16])([H:17])([H:18])[H:19]

[H]O[C:3]([C:2]([C:1]([H:17])([H:18])[H:19])([H:15])[H:16])=[O:4].[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[C:1]([C:2]([C:3](=[O:4])[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27])([H:15])[H:16])([H:17])([H:18])[H:19]

EVODEX.1-P5816

[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[H]C([H])([H])C([H])([H])C(=O)[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]

[H][N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]>>[H]C([H])([H])C([H])([H])C(=O)[N:6]([C:7]([C:8]1:[C:9]([H:20]):[C:10]([H:21]):[C:11]([H:22]):[C:12]([H:23]):[C:13]:1[H:24])([H:25])[H:26])[H:27]