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EVODEX.1-R5618

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([H:29])([H:30])[H:31])([C@:5]([N:6]([H:32])[H:33])([C:7](=[O:8])[N:9]1[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]([H:38])([H:39])[C@:13]1([C:14](=[O:15])[N:16]([C:17]1:[C:18]([H:40]):[C:19]([H:41]):[C:20]2:[C:21](:[C:22]:1[H:42])[O:23][C:24]([H:43])([H:44])[C:25]([H:45])=[C:26]2[C:27]([H:46])([H:47])[H:48])[H:49])[H:50])[H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][O:28][H:58]>>[C:1]([C:2]([C:3]([C:4]([H:29])([H:30])[H:31])([C@:5]([N:6]([H:32])[H:33])([C:7](=[O:8])[N:9]1[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]([H:38])([H:39])[C@:13]1([C:14](=[O:15])[O:28][H:58])[H:50])[H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][N:16]([C:17]1:[C:18]([H:40]):[C:19]([H:41]):[C:20]2:[C:21](:[C:22]:1[H:42])[O:23][C:24]([H:43])([H:44])[C:25]([H:45])=[C:26]2[C:27]([H:46])([H:47])[H:48])[H:49]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
239911 Ile-Pro-7-amido-4-methylcoumarin + H2O = Ile-Pro + 7-amino-4-methylcoumarin False Hordeum vulgare nan 3.4.14.5

Derived Partial Reactions

EVODEX.1-P4819

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:14]([C@@:13]3([H:50])[N:9]([C:7]([C@:5]([C:3]([C:2]([C:1]([H:55])([H:56])[H:57])([H:53])[H:54])([C:4]([H:29])([H:30])[H:31])[H:52])([N:6]([H:32])[H:33])[H:51])=[O:8])[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]3([H:38])[H:39])=[O:15]):C([H]):C:2OC1([H])[H].[H][O:28][H:58]>>[C:1]([C:2]([C:3]([C:4]([H:29])([H:30])[H:31])([C@:5]([N:6]([H:32])[H:33])([C:7](=[O:8])[N:9]1[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]([H:38])([H:39])[C@:13]1([C:14](=[O:15])[O:28][H:58])[H:50])[H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57]

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:14]([C@@:13]3([H:50])[N:9]([C:7]([C@:5]([C:3]([C:2]([C:1]([H:55])([H:56])[H:57])([H:53])[H:54])([C:4]([H:29])([H:30])[H:31])[H:52])([N:6]([H:32])[H:33])[H:51])=[O:8])[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]3([H:38])[H:39])=[O:15]):C([H]):C:2OC1([H])[H].[H][O:28][H:58]>>[C:1]([C:2]([C:3]([C:4]([H:29])([H:30])[H:31])([C@:5]([N:6]([H:32])[H:33])([C:7](=[O:8])[N:9]1[C:10]([H:34])([H:35])[C:11]([H:36])([H:37])[C:12]([H:38])([H:39])[C@:13]1([C:14](=[O:15])[O:28][H:58])[H:50])[H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57]