EVODEX Logo

EVODEX.1-R7119

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
297696 (2R)-2-amino-3-(4-chlorobenzylsulfinyl)propanoic acid = (4-chlorobenzyl)sulfanol + pyruvate + NH4+ False Petiveria alliacea nan 4.4.1.4

Derived Partial Reactions

EVODEX.1-P6541

[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])[S:4](=[O:5])[C:6]([C:7]1:[C:8]([H:17]):[C:9]([H:18]):[C:10]([Cl:11]):[C:12]([H:19]):[C:13]:1[H:20])([H:21])[H:22]>>[H][O:5][S:4][C:6]([C:7]1:[C:8]([H:17]):[C:9]([H:18]):[C:10]([Cl:11]):[C:12]([H:19]):[C:13]:1[H:20])([H:21])[H:22]

[H]OC(=O)[C@@]([H])(N([H])[H])C([H])([H])[S:4](=[O:5])[C:6]([C:7]1:[C:8]([H:17]):[C:9]([H:18]):[C:10]([Cl:11]):[C:12]([H:19]):[C:13]:1[H:20])([H:21])[H:22]>>[H][O:5][S:4][C:6]([C:7]1:[C:8]([H:17]):[C:9]([H:18]):[C:10]([Cl:11]):[C:12]([H:19]):[C:13]:1[H:20])([H:21])[H:22]