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EVODEX.1-R5295

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]([C@:3]([C:4]([H:20])([H:21])[H:22])([C:5]#[N:6])[O:7][C@:8]1([H:23])[O:9][C@@:10]([C:11]([O:12][H:24])([H:25])[H:26])([H:27])[C@:13]([O:14][H:28])([H:29])[C@@:15]([O:16][H:30])([H:31])[C@:17]1([O:18][H:32])[H:33])([H:34])[H:35])([H:36])([H:37])[H:38].[H][O:19][H:39]>>[C:1]([C:2]([C@@:3]([C:4]([H:20])([H:21])[H:22])([C:5]#[N:6])[O:19][H:39])([H:34])[H:35])([H:36])([H:37])[H:38].[H][O:7][C:8]1([H:23])[O:9][C@@:10]([C:11]([O:12][H:24])([H:25])[H:26])([H:27])[C@:13]([O:14][H:28])([H:29])[C@@:15]([O:16][H:30])([H:31])[C@:17]1([O:18][H:32])[H:33]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
223941 lotaustralin + H2O = (2R)-2-hydroxy-2-methylbutanenitrile + D-glucose False Lotus japonicus nan 3.2.1.21

Derived Partial Reactions

EVODEX.1-P4454

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@@:3]([C:2]([C:1]([H:36])([H:37])[H:38])([H:34])[H:35])([C:4]([H:20])([H:21])[H:22])[C:5]#[N:6])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H].[H][O:19][H:39]>>[C:1]([C:2]([C@@:3]([C:4]([H:20])([H:21])[H:22])([C:5]#[N:6])[O:19][H:39])([H:34])[H:35])([H:36])([H:37])[H:38]

[H]OC([H])([H])[C@@]1([H])O[C@@]([H])(O[C@@:3]([C:2]([C:1]([H:36])([H:37])[H:38])([H:34])[H:35])([C:4]([H:20])([H:21])[H:22])[C:5]#[N:6])[C@]([H])(O[H])[C@@]([H])(O[H])[C@]1([H])O[H].[H][O:19][H:39]>>[C:1]([C:2]([C@@:3]([C:4]([H:20])([H:21])[H:22])([C:5]#[N:6])[O:19][H:39])([H:34])[H:35])([H:36])([H:37])[H:38]