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EVODEX.1-R6814

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
280784 3-methoxybenzaldehyde + nitromethane = 1-(3-methoxyphenyl)-2-nitroethanol False Arabidopsis thaliana nan 4.1.2.10

Derived Partial Reactions

EVODEX.1-P6208

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

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