Rule bt0418 Patterns

[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

Aerobic Likelihood:

 Very likely   Likely   Neutral   Unlikely   Very unlikely   Unknown  

Pattern 3806
Pattern 3842
Anthrone derivative -> 2-[(2-Hydroxyphenyl)methyl]benzoate derivative
Anthrone derivative -> 2-Hydroxybenzoylacrylate derivative

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.

Contact Us if you have any comments on rule bt0418.
[Pathway Prediction Engine] [All Rules List] [BBD Main Menu]

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

This is the EAWAG-BBD biotransformation rule, ruleID# bt0418.
It was generated on June 23, 2024 3:14:36 AM CDT.

© 2024, EAWAG.