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EVODEX.1-R6836

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([H:14])([H:15])[H:16])=[O:13])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])([H:32])[H:33].[H][C:1]#[N:2]>>[H][O:13][C@@:11]([C:1]#[N:2])([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([H:31])([H:32])[H:33])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[C:12]([H:14])([H:15])[H:16]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
281103 HCN + 2-decanone = (R)-2-hydroxy-2-methyl-decanenitrile False Prunus mume nan 4.1.2.10

Derived Partial Reactions

EVODEX.1-P6230

[C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([H:14])([H:15])[H:16])=[O:13])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])([H:32])[H:33].[H][C:1]#[N:2]>>[H][O:13][C@@:11]([C:1]#[N:2])([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([H:31])([H:32])[H:33])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[C:12]([H:14])([H:15])[H:16]

[C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([H:14])([H:15])[H:16])=[O:13])([H:17])[H:18])([H:19])[H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])[H:30])([H:31])([H:32])[H:33].[H][C:1]#[N:2]>>[H][O:13][C@@:11]([C:1]#[N:2])([C:10]([C:9]([C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([H:31])([H:32])[H:33])([H:29])[H:30])([H:27])[H:28])([H:25])[H:26])([H:23])[H:24])([H:21])[H:22])([H:19])[H:20])([H:17])[H:18])[C:12]([H:14])([H:15])[H:16]