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EVODEX.1-R4553

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[O:1]=[N+:2]([O-:3])[C:4]1:[C:5]([H:29]):[C:6]([H:30]):[C:7]([O:8][S:9](=[O:10])(=[O:11])[O:12][H:31]):[C:13]([H:32]):[C:14]:1[H:33].[H][O:15][C:16]1:[C:17]([H:34]):[C:18]([H:35]):[C:19]([H:36]):[C:20]([H:37]):[C:21]:1[C:22]1:[C:23]([H:38]):[C:24]([H:39]):[C:25]([H:40]):[C:26]([H:41]):[C:27]:1[O:28][H:42]>>[H][O:8][C:7]1:[C:6]([H:30]):[C:5]([H:29]):[C:4]([N+:2](=[O:1])[O-:3]):[C:14]([H:33]):[C:13]:1[H:32].[S:9](=[O:10])(=[O:11])([O:12][H:31])[O:15][C:16]1:[C:17]([H:34]):[C:18]([H:35]):[C:19]([H:36]):[C:20]([H:37]):[C:21]:1[C:22]1:[C:23]([H:38]):[C:24]([H:39]):[C:25]([H:40]):[C:26]([H:41]):[C:27]:1[O:28][H:42]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
189308 4-nitrophenyl sulfate + 2,2'-bisphenol = 4-nitrophenol + 2,2'-bisphenyl sulfate 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]