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EVODEX.1-R7118

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
297695 (2R)-2-amino-3-(2-methylbenzylsulfinyl)propanoic acid = (2-methylbenzyl)sulfanol + pyruvate + NH4+ False Petiveria alliacea nan 4.4.1.4

Derived Partial Reactions

EVODEX.1-P6540

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

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