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EVODEX.1-R7104

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:7][C:6]([N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20])([C:8](=[O:9])[O:10][H:18])[H:19]>>[H][N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20].[C:6](=[O:7])([C:8](=[O:9])[O:10][H:18])[H:19]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
295916 (S)-2-phenylbutyl-alpha-hydroxy-Gly = (S)-2-phenylbutyl-NH2 + glyoxylate False Bos taurus nan 4.3.2.5

Derived Partial Reactions

EVODEX.1-P6524

[H][O:7][C:6]([N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20])([C:8](=[O:9])[O:10][H:18])[H:19]>>[H][N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20].[C:6](=[O:7])([C:8](=[O:9])[O:10][H:18])[H:19]

[H][O:7][C:6]([N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20])([C:8](=[O:9])[O:10][H:18])[H:19]>>[H][N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20].[C:6](=[O:7])([C:8](=[O:9])[O:10][H:18])[H:19]

EVODEX.1-P6525

[H]OC(=O)C([H])(O[H])[N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20]>>[H][N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20]

[H]OC(=O)C([H])(O[H])[N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20]>>[H][N:5]([C:4]([C@@:3]([C:2]([C:1]([H:31])([H:32])[H:33])([H:29])[H:30])([C:11]1:[C:12]([H:23]):[C:13]([H:24]):[C:14]([H:25]):[C:15]([H:26]):[C:16]:1[H:27])[H:28])([H:21])[H:22])[H:20]