156006-08-5

Basic information

• Product Name: CHEMBRDG-BB 6164257
• Synonyms: CHEMBRDG-BB 6164257;7-(1-METHYL-2-OXOPROPOXY)-2H-CHROMEN-2-ONE;OTAVA-BB 7210430016;7-(1-methyl-2-oxopropoxy)-2H-chromen-2-one(SALTDATA: FREE);7-(1-methyl-2-oxopropoxy)-2-chromenone;7-(1-methyl-2-oxo-propoxy)chromen-2-one;7-(2-keto-1-methyl-propoxy)coumarin;7-(3-oxobutan-2-yloxy)chromen-2-one
• CAS NO: 156006-08-5
• Molecular Formula: C13H12O4
• Molecular Weight: 232.23
• Mol File: 156006-08-5.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 404.1°C at 760 mmHg
• Flash Point: 182.1°C
• Appearance: /
• Density: 1.234g/cm³
• Vapor Pressure: 9.71E-07mmHg at 25°C
• Refractive Index: 1.554
• CAS DataBase Reference: CHEMBRDG-BB 6164257(CAS DataBase Reference)
• NIST Chemistry Reference: CHEMBRDG-BB 6164257(156006-08-5)
• EPA Substance Registry System: CHEMBRDG-BB 6164257(156006-08-5)

Safety Data

• HazardClass: IRRITANT
• Hazardous Substances Data: 156006-08-5(Hazardous Substances Data)

Usage

General Description

CHEMBRDG-BB 6164257 is a chemical compound with the chemical formula C23H13N3O4S2. It is an inhibitor of ATP citrate lyase, an enzyme involved in the production of fatty acids and cholesterol. CHEMBRDG-BB 6164257 has been studied for its potential therapeutic effects in treating metabolic diseases and cancer. Additionally, it has also been investigated for its potential use as a tool compound in research on the role of ATP citrate lyase in various biological processes. Further research is needed to fully understand the properties and potential applications of CHEMBRDG-BB 6164257.

InChI:InChI=1/C13H12O4/c1-8(14)9(2)16-11-5-3-10-4-6-13(15)17-12(10)7-11/h3-7,9H,1-2H3

Upstream product

• 93-35-6 7-hydroxy-2H-chromen-2-one 
• 4091-39-8 3-chloro-2-butanone 

Downstream Products

• 4196-58-1 4',5'-dimethylpsoralen 

Relevant articles and documents

A fluorescence-based assay for Baeyer-Villiger monooxygenases, hydroxylases and lactonases

Alkylation of umbelliferone and nitrophenol with chloroacetone, 3-chlorobutanone, 2-chlorocyclopentanone and 2-chlorocyclohexanone gave the corresponding 2-coumaryloxy and 2-nitrophenoxy ketones. The 2-coumaryloxy ketones were used as fluorogenic substrates to detect Baeyer-Villiger monooxygenases activities of microbial cultures in highthroughput using microtiter plates. The 2-coumaryloxy ketones were oxidized by microorganisms producing Baeyer-Villiger monooxygenases (BVMO), releasing umbelliferone as a fluorescent signal. The substrates were also biotransformed by a microbial monooxygenase (Trichosporon cutaneum). Chemical Baeyer-Villiger oxidation of 2-coumaryloxy ketones using meta-chloroperbenzoic acid proceeded regioselectively to the corresponding acyloxyalkyl derivatives of umbelliferone and nitrophenol. These chiral lactones underwent a fluorogenic and chromogenic reaction upon hydrolysis by esterases, in particular pig liver esterase. Enantioselectivity of the ester hydrolysis reaction was determined by chiral-phase analysis of the unreacted lactones.