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EVODEX.1-R6812

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
280781 2-methylbenzaldehyde + nitromethane = 1-(2-methylphenyl)-2-nitroethanol False Arabidopsis thaliana nan 4.1.2.10

Derived Partial Reactions

EVODEX.1-P6206

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

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