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EVODEX.1-R6962

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:15][C:14]([C@:12]([C@:10]([C:8]([N:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])[C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])=[O:9])([O:11][H:29])[H:37])([O:13][H:30])[H:36])([C:16]([C:17](=[O:18])[C:19](=[O:20])[O:21][H:32])([H:33])[H:34])[H:35]>>[H][C:16]([C:17](=[O:18])[C:19](=[O:20])[O:21][H:32])([H:33])[H:34].[C:1]([C:2]([C:3]([N:4]([C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])[C:8](=[O:9])[C@:10]([O:11][H:29])([C@:12]([O:13][H:30])([C:14](=[O:15])[H:35])[H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
284552 (5R,6R)-7-(dipropylamino)-4,5,6-trihydroxy-2,7-dioxoheptanoic acid = pyruvate + (2R,3S)-2,3-dihydroxy-4-oxo-N,N-dipropylbutanamide {r} False Escherichia coli nan 4.1.3.3

Derived Partial Reactions

EVODEX.1-P6363

[H]OC(=O)C(=O)C([H])([H])[C:14]([C@:12]([C@:10]([C:8]([N:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])[C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])=[O:9])([O:11][H:29])[H:37])([O:13][H:30])[H:36])([O:15][H])[H:35]>>[C:1]([C:2]([C:3]([N:4]([C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])[C:8](=[O:9])[C@:10]([O:11][H:29])([C@:12]([O:13][H:30])([C:14](=[O:15])[H:35])[H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44]

[H]OC(=O)C(=O)C([H])([H])[C:14]([C@:12]([C@:10]([C:8]([N:4]([C:3]([C:2]([C:1]([H:42])([H:43])[H:44])([H:40])[H:41])([H:38])[H:39])[C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])=[O:9])([O:11][H:29])[H:37])([O:13][H:30])[H:36])([O:15][H])[H:35]>>[C:1]([C:2]([C:3]([N:4]([C:5]([C:6]([C:7]([H:22])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])[C:8](=[O:9])[C@:10]([O:11][H:29])([C@:12]([O:13][H:30])([C:14](=[O:15])[H:35])[H:36])[H:37])([H:38])[H:39])([H:40])[H:41])([H:42])([H:43])[H:44]