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EVODEX.1-R5617

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
239910 Tyr-Pro-7-amido-4-methylcoumarin + H2O = Tyr-Pro + 7-amino-4-methylcoumarin False Hordeum vulgare nan 3.4.14.5

Derived Partial Reactions

EVODEX.1-P4817

[H]OC1:C([H]):C([H]):C(C([H])([H])[C@@]([H])(C(=O)N2C([H])([H])C([H])([H])C([H])([H])[C@@]2([H])C(=O)[N:9]([C:8]2:[C:7]([H:36]):[C:6]3:[C:31](:[C:30]([H:56]):[C:29]:2[H:55])[C:2]([C:1]([H:57])([H:58])[H:59])=[C:3]([H:33])[C:4]([H:34])([H:35])[O:5]3)[H:54])N([H])[H]):C([H]):C:1[H]>>[H][N:9]([C:8]1:[C:7]([H:36]):[C:6]2:[C:31](:[C:30]([H:56]):[C:29]:1[H:55])[C:2]([C:1]([H:57])([H:58])[H:59])=[C:3]([H:33])[C:4]([H:34])([H:35])[O:5]2)[H:54]

[H]OC1:C([H]):C([H]):C(C([H])([H])[C@@]([H])(C(=O)N2C([H])([H])C([H])([H])C([H])([H])[C@@]2([H])C(=O)[N:9]([C:8]2:[C:7]([H:36]):[C:6]3:[C:31](:[C:30]([H:56]):[C:29]:2[H:55])[C:2]([C:1]([H:57])([H:58])[H:59])=[C:3]([H:33])[C:4]([H:34])([H:35])[O:5]3)[H:54])N([H])[H]):C([H]):C:1[H]>>[H][N:9]([C:8]1:[C:7]([H:36]):[C:6]2:[C:31](:[C:30]([H:56]):[C:29]:1[H:55])[C:2]([C:1]([H:57])([H:58])[H:59])=[C:3]([H:33])[C:4]([H:34])([H:35])[O:5]2)[H:54]

EVODEX.1-P4818

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:10](=[O:11])[C@:12]3([H:37])[C:13]([H:38])([H:39])[C:14]([H:40])([H:41])[C:15]([H:42])([H:43])[N:16]3[C:17](=[O:18])[C@@:19]([N:20]([H:44])[H:45])([C:21]([C:22]3:[C:23]([H:46]):[C:24]([H:47]):[C:25]([O:26][H:48]):[C:27]([H:49]):[C:28]:3[H:50])([H:51])[H:52])[H:53]):C([H]):C:2OC1([H])[H]>>[H]O[C:10](=[O:11])[C@:12]1([H:37])[C:13]([H:38])([H:39])[C:14]([H:40])([H:41])[C:15]([H:42])([H:43])[N:16]1[C:17](=[O:18])[C@@:19]([N:20]([H:44])[H:45])([C:21]([C:22]1:[C:23]([H:46]):[C:24]([H:47]):[C:25]([O:26][H:48]):[C:27]([H:49]):[C:28]:1[H:50])([H:51])[H:52])[H:53]

[H]C1=C(C([H])([H])[H])C2:C([H]):C([H]):C(N([H])[C:10](=[O:11])[C@:12]3([H:37])[C:13]([H:38])([H:39])[C:14]([H:40])([H:41])[C:15]([H:42])([H:43])[N:16]3[C:17](=[O:18])[C@@:19]([N:20]([H:44])[H:45])([C:21]([C:22]3:[C:23]([H:46]):[C:24]([H:47]):[C:25]([O:26][H:48]):[C:27]([H:49]):[C:28]:3[H:50])([H:51])[H:52])[H:53]):C([H]):C:2OC1([H])[H]>>[H]O[C:10](=[O:11])[C@:12]1([H:37])[C:13]([H:38])([H:39])[C:14]([H:40])([H:41])[C:15]([H:42])([H:43])[N:16]1[C:17](=[O:18])[C@@:19]([N:20]([H:44])[H:45])([C:21]([C:22]1:[C:23]([H:46]):[C:24]([H:47]):[C:25]([O:26][H:48]):[C:27]([H:49]):[C:28]:1[H:50])([H:51])[H:52])[H:53]