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EVODEX.1-R1009

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C:2]([N:1]([H:54])[H:55])([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[H:52].[O:22]=[O:23].[H][O:21][H]>>[C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])(=[O:21])[H:52].[H][N:1]([H:54])[H:55].[H][O:22][O:23][H]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
86777 N1-(thiophen-2-ylmethyl)dodecane-1,12-diamine + H2O + O2 = 12-[(thiophen-2-ylmethyl)amino]dodecanal + NH3 + H2O2 False Homo sapiens P21397 swissprot 1.4.3.4

Derived Partial Reactions

EVODEX.1-P1056

[H]N([H])[C:2]([H])([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[H:52].[O:22]=[O:23]>>O=[C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[H:52].[H][O:22][O:23][H]

[H]N([H])[C:2]([H])([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[H:52].[O:22]=[O:23]>>O=[C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([C:9]([C:10]([C:11]([C:12]([C:13]([N:14]([C:15]([C:16]1:[C:17]([H:24]):[C:18]([H:25]):[C:19]([H:26]):[S:20]:1)([H:27])[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:42])[H:43])([H:44])[H:45])([H:46])[H:47])([H:48])[H:49])([H:50])[H:51])[H:52].[H][O:22][O:23][H]