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EVODEX.1-R6867

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:15][C:14]([C:3]([C:2]([C:1]([H:43])([H:44])[H:45])([H:41])[H:42])([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])[H:40])([C:16]([O:17][H:33])([C:18](=[O:19])[C:20]([O:21][P:22](=[O:23])([O:24][H:34])[O:25][H:35])([H:36])[H:37])[H:38])[H:39]>>[H][C:16]([O:17][H:33])([C:18](=[O:19])[C:20]([O:21][P:22](=[O:23])([O:24][H:34])[O:25][H:35])([H:36])[H:37])[H:38].[C:1]([C:2]([C:3]([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])([C:14](=[O:15])[H:39])[H:40])([H:41])[H:42])([H:43])([H:44])[H:45]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
282149 dihydroxyacetone phosphate + N-Cbz-(2S)-2-aminobutanal = N-Cbz-5-amino-1,3,4-trihydroxyheptan-2-one False Escherichia coli nan 4.1.2.19

Derived Partial Reactions

EVODEX.1-P6263

[H]OC([H])(C(=O)C([H])([H])OP(=O)(O[H])O[H])[C:14]([C:3]([C:2]([C:1]([H:43])([H:44])[H:45])([H:41])[H:42])([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])[H:40])([O:15][H])[H:39]>>[C:1]([C:2]([C:3]([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])([C:14](=[O:15])[H:39])[H:40])([H:41])[H:42])([H:43])([H:44])[H:45]

[H]OC([H])(C(=O)C([H])([H])OP(=O)(O[H])O[H])[C:14]([C:3]([C:2]([C:1]([H:43])([H:44])[H:45])([H:41])[H:42])([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])[H:40])([O:15][H])[H:39]>>[C:1]([C:2]([C:3]([N:4]([C:5](=[O:6])[O:7][C:8]1:[C:9]([H:26]):[C:10]([H:27]):[C:11]([H:28]):[C:12]([H:29]):[C:13]:1[H:30])[H:31])([C:14](=[O:15])[H:39])[H:40])([H:41])[H:42])([H:43])([H:44])[H:45]