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EVODEX.1-R5818

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[N:1]([C:2](=[O:3])[C:4]([C:5]1:[C:6]([H:44]):[C:7](=[O:8]):[O:9]:[C:10]2:[C:11]([H:45]):[C:12]([H:46]):[C:13]([N:14]([C:15](=[O:16])[C@:17]3([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]3[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]3:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:3[H:63])([H:64])[H:65])[H:66])[H:67])[H:68]):[C:41]([H:69]):[C:42]:1:2)([H:70])[H:71])([H:72])[H:73].[H][O:43][H:74]>>[C:15](=[O:16])([C@:17]1([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]1[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]1:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:1[H:63])([H:64])[H:65])[H:66])[H:67])[O:43][H:74].[H][N:14]([C:13]1:[C:12]([H:46]):[C:11]([H:45]):[C:10]2:[O:9]:[C:7](=[O:8]):[C:6]([H:44]):[C:5]([C:4]([C:2]([N:1]([H:72])[H:73])=[O:3])([H:70])[H:71]):[C:42]:2:[C:41]:1[H:69])[H:68]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
243559 Z-Glu-Pro-7-amido-4-carbamoylmethylcoumarin + H2O = Z-Glu-Pro + 7-amino-4-carbamoylmethylcoumarin False Homo sapiens nan 3.4.21.26

Derived Partial Reactions

EVODEX.1-P5040

[H]C1:C(N([H])[C:15](=[O:16])[C@:17]2([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]2[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]2:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:2[H:63])([H:64])[H:65])[H:66])[H:67]):C([H]):C2:C(C([H])([H])C(=O)N([H])[H]):C([H]):C(=O):O:C:2:C:1[H].[H][O:43][H:74]>>[C:15](=[O:16])([C@:17]1([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]1[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]1:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:1[H:63])([H:64])[H:65])[H:66])[H:67])[O:43][H:74]

[H]C1:C(N([H])[C:15](=[O:16])[C@:17]2([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]2[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]2:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:2[H:63])([H:64])[H:65])[H:66])[H:67]):C([H]):C2:C(C([H])([H])C(=O)N([H])[H]):C([H]):C(=O):O:C:2:C:1[H].[H][O:43][H:74]>>[C:15](=[O:16])([C@:17]1([H:47])[C:18]([H:48])([H:49])[C:19]([H:50])([H:51])[C:20]([H:52])([H:53])[N:21]1[C:22](=[O:23])[C@:24]([C:25]([C:26]([C:27](=[O:28])[O:29][H:54])([H:55])[H:56])([H:57])[H:58])([N:30]([C:31](=[O:32])[O:33][C:34]([C:35]1:[C:36]([H:59]):[C:37]([H:60]):[C:38]([H:61]):[C:39]([H:62]):[C:40]:1[H:63])([H:64])[H:65])[H:66])[H:67])[O:43][H:74]