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EVODEX.1-R5140

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]([O:3][P:4](=[O:5])([O:6][C:7]([C:8]([H:18])([H:19])[H:20])([H:21])[H:22])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36])([H:37])[H:38])([H:39])([H:40])[H:41].[H][O:17][H:42]>>[C:7]([C:8]([H:18])([H:19])[H:20])([O:17][H:42])([H:21])[H:22].[H][O:6][P:4]([O:3][C:2]([C:1]([H:39])([H:40])[H:41])([H:37])[H:38])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
217088 (S)-[2-(diethylamino)ethyl] O,O-diethyl phosphorothioate + H2O = diethyl phosphate + 2-(diethylamino)ethane-1-thiol False Brevundimonas diminuta P0A434 uniprot 3.1.8.1

Derived Partial Reactions

EVODEX.1-P4298

[H]C([H])([H])C([H])([H])[O:6][P:4]([O:3][C:2]([C:1]([H:39])([H:40])[H:41])([H:37])[H:38])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[H][O:6][P:4]([O:3][C:2]([C:1]([H:39])([H:40])[H:41])([H:37])[H:38])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]

[H]C([H])([H])C([H])([H])[O:6][P:4]([O:3][C:2]([C:1]([H:39])([H:40])[H:41])([H:37])[H:38])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]>>[H][O:6][P:4]([O:3][C:2]([C:1]([H:39])([H:40])[H:41])([H:37])[H:38])(=[O:5])[S:9][C:10]([C:11]([N:12]([C:13]([C:14]([H:23])([H:24])[H:25])([H:26])[H:27])[C:15]([C:16]([H:28])([H:29])[H:30])([H:31])[H:32])([H:33])[H:34])([H:35])[H:36]