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EVODEX.1-R5589

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
239084 N-methylcarnosine + H2O = N-methyl-beta-Ala + L-His False Homo sapiens Q96KN2 uniprot 3.4.13.20

Derived Partial Reactions

EVODEX.1-P4787

[H]OC(=O)[C@@]([H])(N([H])[C:5]([C:4]([C:3]([N:2]([C:1]([H:32])([H:33])[H:34])[H:31])([H:29])[H:30])([H:27])[H:28])=[O:6])C([H])([H])C1:C([H]):N:C([H]):N:1[H].[H][O:18][H:35]>>[C:1]([N:2]([C:3]([C:4]([C:5](=[O:6])[O:18][H:35])([H:27])[H:28])([H:29])[H:30])[H:31])([H:32])([H:33])[H:34]

[H]OC(=O)[C@@]([H])(N([H])[C:5]([C:4]([C:3]([N:2]([C:1]([H:32])([H:33])[H:34])[H:31])([H:29])[H:30])([H:27])[H:28])=[O:6])C([H])([H])C1:C([H]):N:C([H]):N:1[H].[H][O:18][H:35]>>[C:1]([N:2]([C:3]([C:4]([C:5](=[O:6])[O:18][H:35])([H:27])[H:28])([H:29])[H:30])[H:31])([H:32])([H:33])[H:34]