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EVODEX.1-R4846

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1](=[C:2]([O:3][C:4]([C:5]([H:16])([H:17])[H:18])=[O:6])[H:19])([H:20])[H:21].[H][O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]>>[C:4]([C:5]([H:16])([H:17])[H:18])(=[O:6])[O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28].[H][O:3][C:2](=[C:1]([H:20])[H:21])[H:19]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
196844 (RS)-1-phenylethanol + vinyl acetate = (R)-1-phenylethyl acetate + acetaldehyde + (S)-1-phenylethanol {ir} True Aspergillus oryzae nan 3.1.1.3

Derived Partial Reactions

EVODEX.1-P3998

[H]C([H])=C([H])O[C:4]([C:5]([H:16])([H:17])[H:18])=[O:6].[H][O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]>>[C:4]([C:5]([H:16])([H:17])[H:18])(=[O:6])[O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]

[H]C([H])=C([H])O[C:4]([C:5]([H:16])([H:17])[H:18])=[O:6].[H][O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]>>[C:4]([C:5]([H:16])([H:17])[H:18])(=[O:6])[O:9][C:8]([C:7]([H:29])([H:30])[H:31])([C:10]1:[C:11]([H:23]):[C:12]([H:24]):[C:13]([H:25]):[C:14]([H:26]):[C:15]:1[H:27])[H:28]