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EVODEX.1-R4146

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
168091 p-nitrophenylphosphate + L-3'-deoxy-2',3'-didehydrothymidine = 4-nitrophenol + L-3'-deoxy-2',3'-didehydrothymidine 5'-phosphate False Pantoea agglomerans nan 2.7.1.77

Derived Partial Reactions

EVODEX.1-P3461

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

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