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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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Escherichia coli K-12 substr. MG1655 Compound: pentachlorophenol

Synonyms: PCP

Superclasses: an aromatic compound a chloroaromatic compound
an organohalogen compound an organochlorine compound a chloroaromatic compound

Summary from MetaCyc:
Pentachlorophenol is a polychlorinated aromatic compound used as a wood preservative and broad spectrum biocide.

Chemical Formula: C6OCl5

Molecular Weight: 265.33 Daltons

Monoisotopic Molecular Weight: 263.8470032042 Daltons

SMILES: C1(C(=C(C([O-])=C(Cl)C(Cl)=1)Cl)Cl)Cl

InChI: InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H/p-1

InChIKey: InChIKey=IZUPBVBPLAPZRR-UHFFFAOYSA-M

Unification Links: ChEBI:58217 , HMDB:HMDB41974 , KEGG:C02575 , NCI:263497 , PubChem:4269236

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -20.7

Enzymes inhibited by pentachlorophenol, sorted by the type of inhibition, are:

Inhibitor (Competitive) of: succinate:quinone oxidoreductase [Maklashina99] , fumarate reductase [Maklashina99]


References

Maklashina99: Maklashina E, Cecchini G (1999). "Comparison of catalytic activity and inhibitors of quinone reactions of succinate dehydrogenase (Succinate-ubiquinone oxidoreductase) and fumarate reductase (Menaquinol-fumarate oxidoreductase) from Escherichia coli." Arch Biochem Biophys 1999;369(2);223-32. PMID: 10486141


Report Errors or Provide Feedback
Please cite the following article in publications resulting from the use of EcoCyc: Nucleic Acids Research 41:D605-12 2013
Page generated by SRI International Pathway Tools version 18.5 on Wed Dec 24, 2014, biocyc14.