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EVODEX.1-R1168

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([S+:2]([C:3]([C:4]([C@:5]([N:6]([H:35])[H:36])([C:7](=[O:8])[O:9][H:37])[H:38])([H:39])[H:40])([H:41])[H:42])[C:10]([C@@:11]1([H:43])[O:12][C@:13]([N:14]2:[C:15]([H:44]):[N:16]:[C:17]3:[C:18]([N:19]([H:45])[H:46]):[N:20]:[C:21]([H:47]):[N:22]:[C:23]:2:3)([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[C:28]([C:29]1:[C:30]([H:58]):[C:31]([H:59]):[C:32]([H:60]):[C:33]([H:61]):[N:34]:1)([H:62])([H:63])[H:64]>>[C:1]([N+:34]1:[C:29]([C:28]([H:62])([H:63])[H:64]):[C:30]([H:58]):[C:31]([H:59]):[C:32]([H:60]):[C:33]:1[H:61])([H:55])([H:56])[H:57].[S:2]([C:3]([C:4]([C@:5]([N:6]([H:35])[H:36])([C:7](=[O:8])[O:9][H:37])[H:38])([H:39])[H:40])([H:41])[H:42])[C:10]([C@@:11]1([H:43])[O:12][C@:13]([N:14]2:[C:15]([H:44]):[N:16]:[C:17]3:[C:18]([N:19]([H:45])[H:46]):[N:20]:[C:21]([H:47]):[N:22]:[C:23]:2:3)([H:48])[C@@:24]([O:25][H:49])([H:50])[C@@:26]1([O:27][H:51])[H:52])([H:53])[H:54]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
99384 S-adenosyl-L-methionine + 2-methylpyridine = S-adenosyl-L-homocysteine + 1,2-dimethylpyridinium False Homo sapiens P40261 swissprot 2.1.1.1

Derived Partial Reactions

EVODEX.1-P1224

[H]C([H])([H])[S+:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]>>[S:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]

[H]C([H])([H])[S+:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]>>[S:2]([C:3]([C:4]([C@:5]([N:6]([H:37])[H:38])([C:7](=[O:8])[O:9][H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[C:10]([C@@:11]1([H:45])[O:12][C@:13]([N:14]2:[C:15]([H:46]):[N:16]:[C:17]3:[C:18]([N:19]([H:47])[H:48]):[N:20]:[C:21]([H:49]):[N:22]:[C:23]:2:3)([H:50])[C@@:24]([O:25][H:51])([H:52])[C@@:26]1([O:27][H:53])[H:54])([H:55])[H:56]