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EVODEX.1-R4605

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
190544 4-nitrophenyl sulfate + 2-phenylethanol = 4-nitrophenol + 2-phenylethyl sulfate False Desulfitobacterium hafniense nan 2.8.2.22

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]