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EVODEX.1-R7125

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][C@:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])([O:7][H])[C:8](=[O:9])[S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]>>[H][C:8]([C:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])=[O:7])=[O:9].[H][S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
298082 glutathione + 2,4-dimethylphenylglyoxal = S-(2,4-dimethyl)mandeloylglutathione False Rattus norvegicus nan 4.4.1.5

Derived Partial Reactions

EVODEX.1-P6548

[H][C@:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])([O:7][H])[C:8](=[O:9])[S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]>>[H][C:8]([C:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])=[O:7])=[O:9].[H][S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]

[H][C@:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])([O:7][H])[C:8](=[O:9])[S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]>>[H][C:8]([C:6]([C:5]1:[C:4]([H:34]):[C:3]([H:33]):[C:2]([C:1]([H:57])([H:58])[H:59]):[C:32]([H:56]):[C:30]:1[C:31]([H:53])([H:54])[H:55])=[O:7])=[O:9].[H][S:10][C:11]([C@:12]([N:13]([C:14](=[O:15])[C:16]([C:17]([C@:18]([N:19]([H:36])[H:37])([C:20](=[O:21])[O:22][H:38])[H:39])([H:40])[H:41])([H:42])[H:43])[H:44])([C:23](=[O:24])[N:25]([C:26]([C:27](=[O:28])[O:29][H:45])([H:46])[H:47])[H:48])[H:49])([H:50])[H:51]