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EVODEX.1-R5548

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
238075 beta-homoTyr-Ile-beta-homoTyr + H2O = beta-homoTyr + Ile-beta-homoTyr False Sphingosinicella xenopeptidilytica Q52VH2 uniprot 3.4.11.25

Derived Partial Reactions

EVODEX.1-P4734

[H]OC(=O)C([H])([H])[C@@]([H])(N([H])C(=O)[C@@]([H])(N([H])[C:7](=[O:8])[C:9]([C@@:10]([N:11]([H:40])[H:41])([C:12]([C:13]1:[C:14]([H:42]):[C:15]([H:43]):[C:16]([O:17][H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:49])([H:50])[H:51])C([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])C([H])([H])C1:C([H]):C([H]):C(O[H]):C([H]):C:1[H]>>[H]O[C:7](=[O:8])[C:9]([C@@:10]([N:11]([H:40])[H:41])([C:12]([C:13]1:[C:14]([H:42]):[C:15]([H:43]):[C:16]([O:17][H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:49])([H:50])[H:51]

[H]OC(=O)C([H])([H])[C@@]([H])(N([H])C(=O)[C@@]([H])(N([H])[C:7](=[O:8])[C:9]([C@@:10]([N:11]([H:40])[H:41])([C:12]([C:13]1:[C:14]([H:42]):[C:15]([H:43]):[C:16]([O:17][H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:49])([H:50])[H:51])C([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])C([H])([H])C1:C([H]):C([H]):C(O[H]):C([H]):C:1[H]>>[H]O[C:7](=[O:8])[C:9]([C@@:10]([N:11]([H:40])[H:41])([C:12]([C:13]1:[C:14]([H:42]):[C:15]([H:43]):[C:16]([O:17][H:44]):[C:18]([H:45]):[C:19]:1[H:46])([H:47])[H:48])[H:49])([H:50])[H:51]