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EVODEX.1-R5602

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
239280 Gly-Pro-4-trifluoromethylcoumarin-7-amide + H2O = Gly + Pro + 7-amino-4-trifluoromethylcoumarin False Homo sapiens nan 3.4.13.9

Derived Partial Reactions

EVODEX.1-P4800

[H]N1C([H])([H])C([H])([H])C([H])([H])[C@@]1([H])C(=O)[N:4]([C:5]1:[C:6]([H:25]):[C:7]([H:26]):[C:8]2:[C:9]([C:10]([F:11])([F:12])[F:13]):[C:14]([H:27]):[C:15](=[O:16]):[O:17]:[C:18]:2:[C:19]:1[H:28])[H:29]>>[H][N:4]([C:5]1:[C:6]([H:25]):[C:7]([H:26]):[C:8]2:[C:9]([C:10]([F:11])([F:12])[F:13]):[C:14]([H:27]):[C:15](=[O:16]):[O:17]:[C:18]:2:[C:19]:1[H:28])[H:29]

[H]N1C([H])([H])C([H])([H])C([H])([H])[C@@]1([H])C(=O)[N:4]([C:5]1:[C:6]([H:25]):[C:7]([H:26]):[C:8]2:[C:9]([C:10]([F:11])([F:12])[F:13]):[C:14]([H:27]):[C:15](=[O:16]):[O:17]:[C:18]:2:[C:19]:1[H:28])[H:29]>>[H][N:4]([C:5]1:[C:6]([H:25]):[C:7]([H:26]):[C:8]2:[C:9]([C:10]([F:11])([F:12])[F:13]):[C:14]([H:27]):[C:15](=[O:16]):[O:17]:[C:18]:2:[C:19]:1[H:28])[H:29]