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EVODEX.1-R4805

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C@:2]([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])([O:7][C:8](=[O:9])[C:10]([C@:11]([C:12]([H:24])([H:25])[H:26])([O:13][C:14](=[O:15])[C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[H:34])([H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:20][H:41]>>[C:14](=[O:15])([C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[O:20][H:41].[H][O:13][C@:11]([C:10]([C:8]([O:7][C@:2]([C:1]([H:38])([H:39])[H:40])([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])[H:37])=[O:9])([H:35])[H:36])([C:12]([H:24])([H:25])[H:26])[H:34]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
196122 (R)-3-((R)-3-hydroxybutanoyloxy)2butanoate + H2O = (R)-3-hydroxybutanoate False Paracoccus denitrificans nan 3.1.1.22

Derived Partial Reactions

EVODEX.1-P3954

[C:1]([C@:2]([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])([O:7][C:8](=[O:9])[C:10]([C@:11]([C:12]([H:24])([H:25])[H:26])([O:13][C:14](=[O:15])[C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[H:34])([H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:20][H:41]>>[C:14](=[O:15])([C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[O:20][H:41].[H][O:13][C@:11]([C:10]([C:8]([O:7][C@:2]([C:1]([H:38])([H:39])[H:40])([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])[H:37])=[O:9])([H:35])[H:36])([C:12]([H:24])([H:25])[H:26])[H:34]

[C:1]([C@:2]([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])([O:7][C:8](=[O:9])[C:10]([C@:11]([C:12]([H:24])([H:25])[H:26])([O:13][C:14](=[O:15])[C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[H:34])([H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:20][H:41]>>[C:14](=[O:15])([C:16]([C@@:17]([C:18]([H:27])([H:28])[H:29])([O:19][H:30])[H:31])([H:32])[H:33])[O:20][H:41].[H][O:13][C@:11]([C:10]([C:8]([O:7][C@:2]([C:1]([H:38])([H:39])[H:40])([C:3]([C:4](=[O:5])[O:6][H:21])([H:22])[H:23])[H:37])=[O:9])([H:35])[H:36])([C:12]([H:24])([H:25])[H:26])[H:34]