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EVODEX.1-R6797

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
280358 (4,5-dimethylfuran-2-yl)(hydroxy)propanedioic acid + H+ = (2R)-(4,5-dimethylfuran-2-yl)(hydroxy)acetic acid + CO2 False Bordetella bronchiseptica nan 4.1.1.76

Derived Partial Reactions

EVODEX.1-P6189

[H]OC(=O)[C:5]([C:4]1:[C:3]([H:16]):[C:2]([C:1]([H:23])([H:24])[H:25]):[C:14]([C:15]([H:20])([H:21])[H:22]):[O:13]:1)([O:6][H:17])[C:10](=[O:11])[O:12][H:19]>>[H][C@:5]([C:4]1:[C:3]([H:16]):[C:2]([C:1]([H:23])([H:24])[H:25]):[C:14]([C:15]([H:20])([H:21])[H:22]):[O:13]:1)([O:6][H:17])[C:10](=[O:11])[O:12][H:19]

[H]OC(=O)[C:5]([C:4]1:[C:3]([H:16]):[C:2]([C:1]([H:23])([H:24])[H:25]):[C:14]([C:15]([H:20])([H:21])[H:22]):[O:13]:1)([O:6][H:17])[C:10](=[O:11])[O:12][H:19]>>[H][C@:5]([C:4]1:[C:3]([H:16]):[C:2]([C:1]([H:23])([H:24])[H:25]):[C:14]([C:15]([H:20])([H:21])[H:22]):[O:13]:1)([O:6][H:17])[C:10](=[O:11])[O:12][H:19]