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EVODEX.1-R5392

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
235936 cyclohexene oxide + H2O = (1S,2S)-trans cyclohexanediol + (1R,2R)-trans-cyclohexanediol False Rhodococcus erythropolis nan 3.3.2.8

Derived Partial Reactions

EVODEX.1-P4557

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

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