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EVODEX.1-R6664

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
273405 2,4-diketoheptanoate + H2O = pyruvate + butanoate False Rattus norvegicus nan 3.7.1.2

Derived Partial Reactions

EVODEX.1-P6028

[H]OC(=O)C(=O)C([H])([H])[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5].[H][O:12][H:23]>>[C:1]([C:2]([C:3]([C:4](=[O:5])[O:12][H:23])([H:16])[H:17])([H:18])[H:19])([H:20])([H:21])[H:22]

[H]OC(=O)C(=O)C([H])([H])[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5].[H][O:12][H:23]>>[C:1]([C:2]([C:3]([C:4](=[O:5])[O:12][H:23])([H:16])[H:17])([H:18])[H:19])([H:20])([H:21])[H:22]

EVODEX.1-P6029

[H]OC(=O)C(=O)C([H])([H])[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5]>>[H]O[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5]

[H]OC(=O)C(=O)C([H])([H])[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5]>>[H]O[C:4]([C:3]([C:2]([C:1]([H:20])([H:21])[H:22])([H:18])[H:19])([H:16])[H:17])=[O:5]