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EVODEX.1-R6844

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
281134 HCN + 4-methyl-2-pentanone = (R)-2-hydroxy-2,4-dimethyl-pentanenitrile False Prunus mume nan 4.1.2.10

Derived Partial Reactions

EVODEX.1-P6238

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

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