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EVODEX.1-R4856

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[C:1](=[C:2]([O:3][C:4](=[O:5])[C:6]([C:7]([C:8]([H:14])([H:15])[H:16])([H:17])[H:18])([H:19])[H:20])[H:21])([H:22])[H:23].[H][O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28]>>[C:4](=[O:5])([C:6]([C:7]([C:8]([H:14])([H:15])[H:16])([H:17])[H:18])([H:19])[H:20])[O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28].[H][O:3][C:2](=[C:1]([H:22])[H:23])[H:21]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
197350 (S)-glycidol + vinyl n-butyrate = (2R)-oxiran-2-yl-methyl butanoate + ethenol False Rhizopus arrhizus nan 3.1.1.3

Derived Partial Reactions

EVODEX.1-P4010

[H][O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28]>>[H]C([H])([H])C([H])([H])C([H])([H])C(=O)[O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28]

[H][O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28]>>[H]C([H])([H])C([H])([H])C([H])([H])C(=O)[O:9][C:10]([C@@:11]1([H:24])[C:12]([H:25])([H:26])[O:13]1)([H:27])[H:28]