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EVODEX.1-R6720

Full Hydrogen-Mapped Reaction

SMIRKS

Reaction Rendering

[H][O:1][H:8].[O:2]([C:3]([C:4]([C:5]([C:6]([Cl:7])([H:10])[H:11])([H:12])[H:13])([H:14])[H:15])([H:16])[H:17])[H:18]>>[H][Cl:7].[O:1]([C:6]([C:5]([C:4]([C:3]([O:2][H:18])([H:16])[H:17])([H:14])[H:15])([H:12])[H:13])([H:10])[H:11])[H:8]

Source Database Data

Rxn Index Original Reaction Text Natural Organism Protein Refs Protein DB EC Number
274443 4-chlorobutanol + H2O = butane-1,4-diol + chloride False Corynebacterium sp. nan 3.8.1.5

Derived Partial Reactions

EVODEX.1-P6111

[H][O:1][H:8].[O:2]([C:3]([C:4]([C:5]([C:6]([Cl:7])([H:10])[H:11])([H:12])[H:13])([H:14])[H:15])([H:16])[H:17])[H:18]>>[H][Cl:7].[O:1]([C:6]([C:5]([C:4]([C:3]([O:2][H:18])([H:16])[H:17])([H:14])[H:15])([H:12])[H:13])([H:10])[H:11])[H:8]

[H][O:1][H:8].[O:2]([C:3]([C:4]([C:5]([C:6]([Cl:7])([H:10])[H:11])([H:12])[H:13])([H:14])[H:15])([H:16])[H:17])[H:18]>>[H][Cl:7].[O:1]([C:6]([C:5]([C:4]([C:3]([O:2][H:18])([H:16])[H:17])([H:14])[H:15])([H:12])[H:13])([H:10])[H:11])[H:8]