EVODEX Logo

EVODEX.1-R4588

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:9][C:8]1:[C:7]([H:44]):[C:6]([H:43]):[C:5]([C:4]2([C:12]3:[C:13]([H:48]):[C:14]([H:49]):[C:15]([O:16][S:17](=[O:18])(=[O:19])[O:20][H:50]):[C:21]([H:51]):[C:22]:3[H:52])[O:3][C:2](=[O:1])[C:28]3:[C:23]2:[C:24]([H:53]):[C:25]([H:54]):[C:26]([H:55]):[C:27]:3[H:56]):[C:11]([H:47]):[C:10]:1[H:46].[O:29]=[N+:30]([O-:31])[C:32]1:[C:33]([H:57]):[C:34]([H:58]):[C:35]([O:36][S:37](=[O:38])(=[O:39])[O:40][H:59]):[C:41]([H:60]):[C:42]:1[H:61]>>[O:1]=[C:2]1[O:3][C:4]([C:5]2:[C:6]([H:43]):[C:7]([H:44]):[C:8]([O:9][S:37](=[O:38])(=[O:39])[O:40][H:59]):[C:10]([H:46]):[C:11]:2[H:47])([C:12]2:[C:13]([H:48]):[C:14]([H:49]):[C:15]([O:16][S:17](=[O:18])(=[O:19])[O:20][H:50]):[C:21]([H:51]):[C:22]:2[H:52])[C:23]2:[C:24]([H:53]):[C:25]([H:54]):[C:26]([H:55]):[C:27]([H:56]):[C:28]:21.[H][O:36][C:35]1:[C:34]([H:58]):[C:33]([H:57]):[C:32]([N+:30](=[O:29])[O-:31]):[C:42]([H:61]):[C:41]:1[H:60]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
190503 4-nitrophenyl sulfate + phenolphthalein = phenolphthalein O-sulfate + 4-nitrophenol False Eubacterium sp. 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]