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EVODEX.1-R5533

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
238021 L-Pro-OMe + beta-Ala-OBzl + beta-Ala-OBzl = L-Pro-(beta-Ala)2-OBzl + methanol + benzyl alcohol False Streptomyces thermocyaneoviolaceus nan 3.4.11.24

Derived Partial Reactions

EVODEX.1-P4715

[H][N:1]([C:2]([C:3]([C:4](=[O:5])[O:6][C:7]([C:8]1:[C:9]([H:34]):[C:10]([H:35]):[C:11]([H:36]):[C:12]([H:37]):[C:13]:1[H:38])([H:39])[H:40])([H:41])[H:42])([H:43])[H:44])[H:45].[H]C1:C([H]):C([H]):C(C([H])([H])O[C:15](=[O:14])[C:16]([C:17]([N:18]([C:19](=[O:20])[C@:21]2([H:47])[C:22]([H:48])([H:49])[C:23]([H:50])([H:51])[C:24]([H:52])([H:53])[N:25]2[H:54])[H:55])([H:56])[H:57])([H:58])[H:59]):C([H]):C:1[H]>>[N:1]([C:2]([C:3]([C:4](=[O:5])[O:6][C:7]([C:8]1:[C:9]([H:34]):[C:10]([H:35]):[C:11]([H:36]):[C:12]([H:37]):[C:13]:1[H:38])([H:39])[H:40])([H:41])[H:42])([H:43])[H:44])([C:15](=[O:14])[C:16]([C:17]([N:18]([C:19](=[O:20])[C@:21]1([H:47])[C:22]([H:48])([H:49])[C:23]([H:50])([H:51])[C:24]([H:52])([H:53])[N:25]1[H:54])[H:55])([H:56])[H:57])([H:58])[H:59])[H:45]

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