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EVODEX.1-R4932

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
200081 butylthiocholine + H2O = thiocholine + butanol False Rhopalosiphum padi nan 3.1.1.7

Derived Partial Reactions

EVODEX.1-P4089

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

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