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EVODEX.1-R6200

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[N:1]([C:2](=[O:3])[C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])([H:41])[H:42]>>[C:2](=[O:3])([C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])[N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[H][N:1]([H:41])[H:42]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
253039 4-chloro-L-phenylalanine + phenylacetamide = N-[(4-chlorophenyl)acetyl]-L-tyrosine + NH3 False Alcaligenes faecalis nan 3.5.1.11

Derived Partial Reactions

EVODEX.1-P5454

[H][N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[N:1]([C:2](=[O:3])[C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])([H:41])[H:42]>>[C:2](=[O:3])([C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])[N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[H][N:1]([H:41])[H:42]

[H][N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[N:1]([C:2](=[O:3])[C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])([H:41])[H:42]>>[C:2](=[O:3])([C:4]([C:5]1:[C:6]([H:34]):[C:7]([H:35]):[C:8]([H:36]):[C:9]([H:37]):[C:10]:1[H:38])([H:39])[H:40])[N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32].[H][N:1]([H:41])[H:42]

EVODEX.1-P5455

[H][N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32]>>[H]C1:C([H]):C([H]):C(C([H])([H])C(=O)[N:11]([C@@:12]([C:13]([C:14]2:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:2[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32]):C([H]):C:1[H]

[H][N:11]([C@@:12]([C:13]([C:14]1:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:1[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32]>>[H]C1:C([H]):C([H]):C(C([H])([H])C(=O)[N:11]([C@@:12]([C:13]([C:14]2:[C:15]([H:24]):[C:16]([H:25]):[C:17]([Cl:18]):[C:19]([H:26]):[C:20]:2[H:27])([H:28])[H:29])([C:21](=[O:22])[O:23][H:30])[H:31])[H:32]):C([H]):C:1[H]