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EVODEX.1-R238

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
35393 4-pyridoxate + 2,6-dichloroindophenol = 5-formyl-3-hydroxy-2-methylpyridine-4-carboxylate + reduced 2,6-dichloroindophenol True Mesorhizobium loti Q988C9 uniprot 1.1.99.42

Derived Partial Reactions

EVODEX.1-P189

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

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