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EVODEX.1-R5592

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]1:[C:3]([C:4]([H:27])([H:28])[H:29]):[N:5]2:[C:6]([C:7]([S:8][C:9]([C@:10]([N:11]([H:30])[H:31])([C:12](=[O:13])[N:14]([C:15]([C:16](=[O:17])[O:18][H:32])([H:33])[H:34])[H:35])[H:36])([H:37])[H:38])([H:39])[H:40]):[C:19]([C:20]([H:41])([H:42])[H:43]):[C:21](=[O:22]):[N:23]:2:[C:24]:1=[O:25])([H:44])([H:45])[H:46].[H][O:26][H:47]>>[C:1]([C:2]1:[C:3]([C:4]([H:27])([H:28])[H:29]):[N:5]2:[C:6]([C:7]([S:8][C:9]([C@:10]([N:11]([H:30])[H:31])([C:12](=[O:13])[O:26][H:47])[H:36])([H:37])[H:38])([H:39])[H:40]):[C:19]([C:20]([H:41])([H:42])[H:43]):[C:21](=[O:22]):[N:23]:2:[C:24]:1=[O:25])([H:44])([H:45])[H:46].[H][N:14]([C:15]([C:16](=[O:17])[O:18][H:32])([H:33])[H:34])[H:35]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
239154 bimane S-cysteinylglycine + H2O = bimane S-cysteine + glycine False Rattus norvegicus Q68FS4 uniprot 3.4.13.23

Derived Partial Reactions

EVODEX.1-P4790

[H]OC(=O)C([H])([H])N([H])[C:12]([C@:10]([C:9]([S:8][C:7]([C:6]1:[N:5]2:[C:3]([C:4]([H:27])([H:28])[H:29]):[C:2]([C:1]([H:44])([H:45])[H:46]):[C:24](=[O:25]):[N:23]:2:[C:21](=[O:22]):[C:19]:1[C:20]([H:41])([H:42])[H:43])([H:39])[H:40])([H:37])[H:38])([N:11]([H:30])[H:31])[H:36])=[O:13]>>[H]O[C:12]([C@:10]([C:9]([S:8][C:7]([C:6]1:[N:5]2:[C:3]([C:4]([H:27])([H:28])[H:29]):[C:2]([C:1]([H:44])([H:45])[H:46]):[C:24](=[O:25]):[N:23]:2:[C:21](=[O:22]):[C:19]:1[C:20]([H:41])([H:42])[H:43])([H:39])[H:40])([H:37])[H:38])([N:11]([H:30])[H:31])[H:36])=[O:13]

[H]OC(=O)C([H])([H])N([H])[C:12]([C@:10]([C:9]([S:8][C:7]([C:6]1:[N:5]2:[C:3]([C:4]([H:27])([H:28])[H:29]):[C:2]([C:1]([H:44])([H:45])[H:46]):[C:24](=[O:25]):[N:23]:2:[C:21](=[O:22]):[C:19]:1[C:20]([H:41])([H:42])[H:43])([H:39])[H:40])([H:37])[H:38])([N:11]([H:30])[H:31])[H:36])=[O:13]>>[H]O[C:12]([C@:10]([C:9]([S:8][C:7]([C:6]1:[N:5]2:[C:3]([C:4]([H:27])([H:28])[H:29]):[C:2]([C:1]([H:44])([H:45])[H:46]):[C:24](=[O:25]):[N:23]:2:[C:21](=[O:22]):[C:19]:1[C:20]([H:41])([H:42])[H:43])([H:39])[H:40])([H:37])[H:38])([N:11]([H:30])[H:31])[H:36])=[O:13]