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EVODEX.1-R4990

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

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

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
202666 N-(3-oxohexanoyl)-L-homoserine lactone + H2O = L-homoserine lactone + 3-oxohexanoate False Bacillus thuringiensis serovar kyushuensis D8VDY4 uniprot 3.1.1.81

Derived Partial Reactions

EVODEX.1-P4153

[H]N([C@]1([H])C(=O)OC([H])([H])C1([H])[H])[C:7]([C:6]([C:4]([C:3]([C:2]([C:1]([H:29])([H:30])[H:31])([H:27])[H:28])([H:25])[H:26])=[O:5])([H:23])[H:24])=[O:8].[H][O:16][H:32]>>[C:1]([C:2]([C:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:16][H:32])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])([H:30])[H:31]

[H]N([C@]1([H])C(=O)OC([H])([H])C1([H])[H])[C:7]([C:6]([C:4]([C:3]([C:2]([C:1]([H:29])([H:30])[H:31])([H:27])[H:28])([H:25])[H:26])=[O:5])([H:23])[H:24])=[O:8].[H][O:16][H:32]>>[C:1]([C:2]([C:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:16][H:32])([H:23])[H:24])([H:25])[H:26])([H:27])[H:28])([H:29])([H:30])[H:31]