Rule bt0418

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Pattern 3806        All patterns
Anthrone derivative -> 2-[(2-Hydroxyphenyl)methyl]benzoate derivative
Anthrone derivative -> 2-Hydroxybenzoylacrylate derivative

Aerobic Likelihood:              Neutral

EAWAG-BBD Reaction(s):
Not found

This rule handles Baeyer-Villiger oxidation (bt0071) of anthrone derivatives and subsequent hydrolysis of the cyclic ester (bt0024). This rule is needed because the partial aromatic nature of the BV oxidation product does not permit its hydrolysis by bt0024. The oxidation and cleavage occurs between the carbonyl carbon and neighboring carbon with the biggest sigma charge.

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Page Author(s): Michael Turnbull
August 05, 2010

This is the EAWAG-BBD biotransformation rule, ruleID# bt0418.
It was generated on May 21, 2024 9:56:17 PM CDT.

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