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EVODEX.1-R1909

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:6][C:4]([C:2]([C:1]([H:20])([H:21])[H:22])=[O:3])=[O:5].[C:7]([C:8]([C:9]([H:23])([H:24])[H:25])([C:10]([H:26])([H:27])[H:28])[C:11]1:[C:12]([H:29]):[C:13]([H:30]):[C:14]([C:15](=[O:16])[H:31]):[C:17]([H:32]):[C:18]:1[H:33])([H:34])([H:35])[H:36]>>[C:4](=[O:5])=[O:6].[H][O:16][C@@:15]([C:2]([C:1]([H:20])([H:21])[H:22])=[O:3])([C:14]1:[C:13]([H:30]):[C:12]([H:29]):[C:11]([C:8]([C:7]([H:34])([H:35])[H:36])([C:9]([H:23])([H:24])[H:25])[C:10]([H:26])([H:27])[H:28]):[C:18]([H:33]):[C:17]:1[H:32])[H:31]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
109717 4-(tert-butyl)benzaldehyde + pyruvate = (R)-1-hydroxy-1-(4-(tert-butyl)phenyl)propan-2-one + CO2 False Azoarcus sp. nan 2.2.1.6

Derived Partial Reactions

EVODEX.1-P1396

[C:7]([C:8]([C:9]([H:23])([H:24])[H:25])([C:10]([H:26])([H:27])[H:28])[C:11]1:[C:12]([H:29]):[C:13]([H:30]):[C:14]([C:15](=[O:16])[H:31]):[C:17]([H:32]):[C:18]:1[H:33])([H:34])([H:35])[H:36]>>[H]C([H])([H])C(=O)[C@@:15]([C:14]1:[C:13]([H:30]):[C:12]([H:29]):[C:11]([C:8]([C:7]([H:34])([H:35])[H:36])([C:9]([H:23])([H:24])[H:25])[C:10]([H:26])([H:27])[H:28]):[C:18]([H:33]):[C:17]:1[H:32])([O:16][H])[H:31]

[C:7]([C:8]([C:9]([H:23])([H:24])[H:25])([C:10]([H:26])([H:27])[H:28])[C:11]1:[C:12]([H:29]):[C:13]([H:30]):[C:14]([C:15](=[O:16])[H:31]):[C:17]([H:32]):[C:18]:1[H:33])([H:34])([H:35])[H:36]>>[H]C([H])([H])C(=O)[C@@:15]([C:14]1:[C:13]([H:30]):[C:12]([H:29]):[C:11]([C:8]([C:7]([H:34])([H:35])[H:36])([C:9]([H:23])([H:24])[H:25])[C:10]([H:26])([H:27])[H:28]):[C:18]([H:33]):[C:17]:1[H:32])([O:16][H])[H:31]