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EVODEX.1-R3288

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([S+:2]([C:3]([C:4]([C:5]([N:6]([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([H:40])[H:41])[C:7]([C@@:8]1([H:42])[O:9][C@:10]([N:11]2:[C:12]([H:43]):[N:13]:[C:14]3:[C:15]([N:16]([H:44])[H:45]):[N:17]:[C:18]([H:46]):[N:19]:[C:20]:2:3)([H:47])[C@@:21]([O:22][H:48])([H:49])[C@@:23]1([O:24][H:50])[H:51])([H:52])[H:53])([H:54])([H:55])[H:56].[H][N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59]>>[C:3]([C:4]([C:5]([N:6]([H:34])[H:35])([H:36])[H:37])([H:38])[H:39])([N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59])([H:40])[H:41].[C:1]([S:2][C:7]([C@@:8]1([H:42])[O:9][C@:10]([N:11]2:[C:12]([H:43]):[N:13]:[C:14]3:[C:15]([N:16]([H:44])[H:45]):[N:17]:[C:18]([H:46]):[N:19]:[C:20]:2:3)([H:47])[C@@:21]([O:22][H:48])([H:49])[C@@:23]1([O:24][H:50])[H:51])([H:52])[H:53])([H:54])([H:55])[H:56].[HH]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
146391 S-adenosyl 3-(methylthio)propylamine + agmatine = 5'-S-methyl-5'-thioadenosine + N1-aminopropylagmatine True Pyrococcus furiosus Q8U4G1 swissprot 2.5.1.104

Derived Partial Reactions

EVODEX.1-P2544

[H][N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59]>>[H]N([H])C([H])([H])C([H])([H])C([H])([H])[N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59]

[H][N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59]>>[H]N([H])C([H])([H])C([H])([H])C([H])([H])[N:33]([C:32]([C:31]([C:30]([C:29]([N:28]([C:26](=[N:25][H:70])[N:27]([H:57])[H:58])[H:69])([H:67])[H:68])([H:65])[H:66])([H:63])[H:64])([H:61])[H:62])[H:59]