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EVODEX.1-R4565

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
189638 AMP + 4-nitrophenyl sulfate = adenosine 5'-phosphate 5'-sulfate + 4-nitrophenol False Rattus norvegicus nan 2.8.2.1

Derived Partial Reactions

EVODEX.1-P3728

[H]OS(=O)(=O)[O:35][C:34]1:[C:33]([H:58]):[C:32]([H:57]):[C:31]([N+:29](=[O:28])[O-:30]):[C:41]([H:61]):[C:40]:1[H:60]>>[H][O:35][C:34]1:[C:33]([H:58]):[C:32]([H:57]):[C:31]([N+:29](=[O:28])[O-:30]):[C:41]([H:61]):[C:40]:1[H:60]

[H]OS(=O)(=O)[O:35][C:34]1:[C:33]([H:58]):[C:32]([H:57]):[C:31]([N+:29](=[O:28])[O-:30]):[C:41]([H:61]):[C:40]:1[H:60]>>[H][O:35][C:34]1:[C:33]([H:58]):[C:32]([H:57]):[C:31]([N+:29](=[O:28])[O-:30]):[C:41]([H:61]):[C:40]:1[H:60]