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EVODEX.1-R223

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
34903 (R)-Pantolactone + 2,6-dichlorophenol-indophenol = 2-Dehydropantonolactone + reduced 2,6-dichlorophenol-indophenol False Nocardia asteroides nan 1.1.99.27

Derived Partial Reactions

EVODEX.1-P45

[H][C@@:8]1([O:9][H])[C:2]([C:1]([H:65])([H:66])[H:67])([C:3]([H:58])([H:59])[H:60])[C:4]([H:61])([H:62])[O:5][C:6]1=[O:7]>>[C:1]([C:2]1([C:3]([H:58])([H:59])[H:60])[C:4]([H:61])([H:62])[O:5][C:6](=[O:7])[C:8]1=[O:9])([H:65])([H:66])[H:67]

[H][C@@:8]1([O:9][H])[C:2]([C:1]([H:65])([H:66])[H:67])([C:3]([H:58])([H:59])[H:60])[C:4]([H:61])([H:62])[O:5][C:6]1=[O:7]>>[C:1]([C:2]1([C:3]([H:58])([H:59])[H:60])[C:4]([H:61])([H:62])[O:5][C:6](=[O:7])[C:8]1=[O:9])([H:65])([H:66])[H:67]