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EVODEX.1-R4554

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[O:19]=[N+:20]([O-:21])[C:22]1:[C:23]([H:33]):[C:24]([H:34]):[C:25]([O:26][S:27](=[O:28])(=[O:29])[O:30][H:35]):[C:31]([H:36]):[C:32]:1[H:37].[H][O:18][C:17]1:[C:12]([C:11]2:[C:6]([O:5][S:2](=[O:1])(=[O:3])[O:4][H:38]):[C:7]([H:39]):[C:8]([H:40]):[C:9]([H:41]):[C:10]:2[H:42]):[C:13]([H:43]):[C:14]([H:44]):[C:15]([H:45]):[C:16]:1[H:46]>>[H][O:26][C:25]1:[C:24]([H:34]):[C:23]([H:33]):[C:22]([N+:20](=[O:19])[O-:21]):[C:32]([H:37]):[C:31]:1[H:36].[O:1]=[S:2](=[O:3])([O:4][H:38])[O:5][C:6]1:[C:7]([H:39]):[C:8]([H:40]):[C:9]([H:41]):[C:10]([H:42]):[C:11]:1[C:12]1:[C:13]([H:43]):[C:14]([H:44]):[C:15]([H:45]):[C:16]([H:46]):[C:17]:1[O:18][S:27](=[O:28])(=[O:29])[O:30][H:35]

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]