EVODEX Logo

EVODEX.1-R1893

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:17][C:15]([C:13]([C:12]([H:19])([H:20])[H:21])=[O:14])=[O:16].[C:1]([C:2](=[O:3])[C:4](=[C:5]([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])[H:27])[H:28])([H:29])([H:30])[H:31]>>[C:15](=[O:16])=[O:17].[H][C:4]([C:2]([C:1]([H:29])([H:30])[H:31])=[O:3])([C@:5]([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])([C:13]([C:12]([H:19])([H:20])[H:21])=[O:14])[H:27])[H:28]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
109044 pyruvate + (3E)-4-phenylbut-3-en-2-one = (3R)-3-phenylhexane-2,5-dione + CO2 False Serratia marcescens Q5W251 uniprot 2.2.1.12

Derived Partial Reactions

EVODEX.1-P1376

[C:1]([C:2](=[O:3])[C:4](=[C:5]([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])[H:27])[H:28])([H:29])([H:30])[H:31]>>[H]C([H])([H])C(=O)[C@:5]([C:4]([H])([C:2]([C:1]([H:29])([H:30])[H:31])=[O:3])[H:28])([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])[H:27]

[C:1]([C:2](=[O:3])[C:4](=[C:5]([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])[H:27])[H:28])([H:29])([H:30])[H:31]>>[H]C([H])([H])C(=O)[C@:5]([C:4]([H])([C:2]([C:1]([H:29])([H:30])[H:31])=[O:3])[H:28])([C:6]1:[C:7]([H:22]):[C:8]([H:23]):[C:9]([H:24]):[C:10]([H:25]):[C:11]:1[H:26])[H:27]