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EVODEX.1-R528

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C@:15]1([C@:13]([C@:11]([C:10]([H:41])([H:42])[H:43])([O:12][H:29])[H:40])([O:14][H:30])[H:39])[C:16]([H:32])([H:33])[N:17]([H:34])[C:18]2:[N:19]([H:35]):[C:20](=[N:21][H:36]):[N:22]([H:37]):[C:23](=[O:24]):[C:25]:2[N:26]1[H].[H][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50].[O:27]=[O:28]>>[C:10]([C@:11]([O:12][H:29])([C@:13]([O:14][H:30])([C:15]1=[N:26][C:25]2:[C:18](:[N:19]([H:35]):[C:20](=[N:21][H:36]):[N:22]([H:37]):[C:23]:2=[O:24])[N:17]([H:34])[C:16]1([H:32])[H:33])[H:39])[H:40])([H:41])([H:42])[H:43].[H][O:27][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50].[H][O:28][H]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
53853 (S)-ethyl-L-cysteine + 5,6,7,8-tetrahydrobiopterin + O2 = (S)-ethyl-L-cysteine S-oxide + dihydrobiopterin + H2O False Homo sapiens P00439 swissprot 1.14.16.1

Derived Partial Reactions

EVODEX.1-P551

[H][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50].O=[O:27]>>[H][O:27][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50]

[H][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50].O=[O:27]>>[H][O:27][C:2]([C:1]([H:52])([H:53])[H:54])([S:3][C:4]([C@:5]([N:6]([H:44])[H:45])([C:7](=[O:8])[O:9][H:46])[H:47])([H:48])[H:49])[H:50]