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EVODEX.1-R7129

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[N:1]([C@@:2]([C:3]([Cl:4])([H:14])[H:15])([C:5](=[O:6])[O:7][H:16])[H:17])([H:18])[H:19].[H][S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23]>>[H][Cl:4].[N:1]([C@@:2]([C:3]([S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23])([H:14])[H:15])([C:5](=[O:6])[O:7][H:16])[H:17])([H:18])[H:19]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
298312 3-chloro-L-alanine + 1-thioglycerol = S-2,3-dihydroxypropyl-L-cysteine + Cl- False Escherichia coli nan 4.5.1.5

Derived Partial Reactions

EVODEX.1-P6550

[H][S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23]>>[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])[S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23]

[H][S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23]>>[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])[S:13][C:12]([C:10]([C:9]([O:8][H:27])([H:25])[H:26])([O:11][H:20])[H:24])([H:22])[H:23]