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EVODEX.1-R5474

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]1:[C:3]2:[N:4]:[C:5]3:[C:6]([H:25]):[C:7]([H:26]):[C:8]([N:9]([C:10](=[O:11])[C:12]([C:13]([N:14]([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[H:33]):[C:15]([H:34]):[C:16]:3:[O:17]:[C:18]2:[C:19]([H:35]):[C:20](=[O:21]):[C:22]:1[C:23]([H:36])([H:37])[H:38])([H:39])([H:40])[H:41].[H][O:24][H:42]>>[C:10](=[O:11])([C:12]([C:13]([N:14]([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[O:24][H:42].[H][N:9]([C:8]1:[C:7]([H:26]):[C:6]([H:25]):[C:5]2:[N:4]:[C:3]3:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:22]([C:23]([H:36])([H:37])[H:38]):[C:20](=[O:21]):[C:19]([H:35]):[C:18]3:[O:17]:[C:16]:2:[C:15]:1[H:34])[H:33]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
237327 7-N-(beta-alanyl)amino-1,2-dimethyl-3H-phenoxazin-3-one + H2O = 7-N-amino-1,2-dimethyl-3H-phenoxazin-3-one + beta-alanine False Pseudomonas aeruginosa nan 3.4.11.2

Derived Partial Reactions

EVODEX.1-P4653

[H]N([H])C([H])([H])C([H])([H])C(=O)[N:9]([C:8]1:[C:7]([H:26]):[C:6]([H:25]):[C:5]2:[N:4]:[C:3]3:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:22]([C:23]([H:36])([H:37])[H:38]):[C:20](=[O:21]):[C:19]([H:35]):[C:18]3:[O:17]:[C:16]:2:[C:15]:1[H:34])[H:33]>>[H][N:9]([C:8]1:[C:7]([H:26]):[C:6]([H:25]):[C:5]2:[N:4]:[C:3]3:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:22]([C:23]([H:36])([H:37])[H:38]):[C:20](=[O:21]):[C:19]([H:35]):[C:18]3:[O:17]:[C:16]:2:[C:15]:1[H:34])[H:33]

[H]N([H])C([H])([H])C([H])([H])C(=O)[N:9]([C:8]1:[C:7]([H:26]):[C:6]([H:25]):[C:5]2:[N:4]:[C:3]3:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:22]([C:23]([H:36])([H:37])[H:38]):[C:20](=[O:21]):[C:19]([H:35]):[C:18]3:[O:17]:[C:16]:2:[C:15]:1[H:34])[H:33]>>[H][N:9]([C:8]1:[C:7]([H:26]):[C:6]([H:25]):[C:5]2:[N:4]:[C:3]3:[C:2]([C:1]([H:39])([H:40])[H:41]):[C:22]([C:23]([H:36])([H:37])[H:38]):[C:20](=[O:21]):[C:19]([H:35]):[C:18]3:[O:17]:[C:16]:2:[C:15]:1[H:34])[H:33]