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EVODEX.1-R5690

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
240817 3-(2-furyl)acryloyl-L-Phe-L-Trp + H2O = 3-(2-furyl)acryloyl-L-Phe + L-Trp False Homo sapiens nan 3.4.17.1

Derived Partial Reactions

EVODEX.1-P4900

[H]OC(=O)[C@@]([H])(N([H])[C:20]([C@@:12]([N:11]([C:3](=[O:2])[C:4](=[C:5]([C:6]1:[C:7]([H:37]):[C:8]([H:38]):[C:9]([H:39]):[O:10]:1)[H:40])[H:41])[H:61])([C:13]([C:14]1:[C:15]([H:42]):[C:16]([H:43]):[C:17]([H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:60])=[O:21])C([H])([H])C1:C([H]):N([H]):C2:C([H]):C([H]):C([H]):C([H]):C:1:2>>[H]O[C:20]([C@@:12]([N:11]([C:3](=[O:2])[C:4](=[C:5]([C:6]1:[C:7]([H:37]):[C:8]([H:38]):[C:9]([H:39]):[O:10]:1)[H:40])[H:41])[H:61])([C:13]([C:14]1:[C:15]([H:42]):[C:16]([H:43]):[C:17]([H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:60])=[O:21]

[H]OC(=O)[C@@]([H])(N([H])[C:20]([C@@:12]([N:11]([C:3](=[O:2])[C:4](=[C:5]([C:6]1:[C:7]([H:37]):[C:8]([H:38]):[C:9]([H:39]):[O:10]:1)[H:40])[H:41])[H:61])([C:13]([C:14]1:[C:15]([H:42]):[C:16]([H:43]):[C:17]([H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:60])=[O:21])C([H])([H])C1:C([H]):N([H]):C2:C([H]):C([H]):C([H]):C([H]):C:1:2>>[H]O[C:20]([C@@:12]([N:11]([C:3](=[O:2])[C:4](=[C:5]([C:6]1:[C:7]([H:37]):[C:8]([H:38]):[C:9]([H:39]):[O:10]:1)[H:40])[H:41])[H:61])([C:13]([C:14]1:[C:15]([H:42]):[C:16]([H:43]):[C:17]([H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:60])=[O:21]