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EVODEX.1-R5529

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
238009 L-Met-OMe + beta-Ala-OBzl + beta-Ala-OBzl = beta-Ala-L-Met-beta-Ala-OBzl + benzyl alcohol + methanol False Streptomyces thermocyaneoviolaceus nan 3.4.11.24

Derived Partial Reactions

EVODEX.1-P4711

[C:1]([S:2][C:3]([C:4]([C@:5]([N:6]([C:7](=[O:8])[C:9]([C:10]([N:11]([H:35])[H:36])([H:37])[H:38])([H:39])[H:40])[H:41])([C:12](=[O:13])[N:14]([C:15]([C:16]([C:17](=[O:18])[O:19][C:20]([C:21]1:[C:22]([H:42]):[C:23]([H:43]):[C:24]([H:44]):[C:25]([H:45]):[C:26]:1[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:58])([H:59])([H:60])[H:61]>>[H]C1:C([H]):C([H]):C(C([H])([H])O[C:7](=[O:8])[C:9]([C:10]([N:11]([H:35])[H:36])([H:37])[H:38])([H:39])[H:40]):C([H]):C:1[H].[H][N:6]([C@@:5]([C:4]([C:3]([S:2][C:1]([H:59])([H:60])[H:61])([H:57])[H:58])([H:55])[H:56])([C:12](=[O:13])[N:14]([C:15]([C:16]([C:17](=[O:18])[O:19][C:20]([C:21]1:[C:22]([H:42]):[C:23]([H:43]):[C:24]([H:44]):[C:25]([H:45]):[C:26]:1[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])[H:53])[H:54])[H:41]

[C:1]([S:2][C:3]([C:4]([C@:5]([N:6]([C:7](=[O:8])[C:9]([C:10]([N:11]([H:35])[H:36])([H:37])[H:38])([H:39])[H:40])[H:41])([C:12](=[O:13])[N:14]([C:15]([C:16]([C:17](=[O:18])[O:19][C:20]([C:21]1:[C:22]([H:42]):[C:23]([H:43]):[C:24]([H:44]):[C:25]([H:45]):[C:26]:1[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:58])([H:59])([H:60])[H:61]>>[H]C1:C([H]):C([H]):C(C([H])([H])O[C:7](=[O:8])[C:9]([C:10]([N:11]([H:35])[H:36])([H:37])[H:38])([H:39])[H:40]):C([H]):C:1[H].[H][N:6]([C@@:5]([C:4]([C:3]([S:2][C:1]([H:59])([H:60])[H:61])([H:57])[H:58])([H:55])[H:56])([C:12](=[O:13])[N:14]([C:15]([C:16]([C:17](=[O:18])[O:19][C:20]([C:21]1:[C:22]([H:42]):[C:23]([H:43]):[C:24]([H:44]):[C:25]([H:45]):[C:26]:1[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])[H:53])[H:54])[H:41]