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EVODEX.1-R4556

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
189310 4-nitrophenyl sulfate + 4-coumaric acid = 4-nitrophenol + 4-sulfocinnamic acid False Desulfitobacterium hafniense 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]