121124-66-1

Basic information

• Product Name: S-(2-oxopentadecyl)-coenzyme A
• Synonyms: S-(2-oxopentadecyl)-coenzyme A
• CAS NO: 121124-66-1
• Molecular Formula: C36H64 N7 O17 P3 S
• Molecular Weight: 991.92
• Mol File: 121124-66-1.mol
• Article Data: 1

Chemical Properties

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Appearance: /
• Density: 1.56g/cm³
• Refractive Index: 1.637
• CAS DataBase Reference: S-(2-oxopentadecyl)-coenzyme A(CAS DataBase Reference)
• NIST Chemistry Reference: S-(2-oxopentadecyl)-coenzyme A(121124-66-1)
• EPA Substance Registry System: S-(2-oxopentadecyl)-coenzyme A(121124-66-1)

Safety Data

• Hazardous Substances Data: 121124-66-1(Hazardous Substances Data)

Usage

InChI:InChI=1/C36H64N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-25(44)21-64-19-18-38-27(45)16-17-39-34(48)31(47)36(2,3)22-57-63(54,55)60-62(52,53)56-20-26-30(59-61(49,50)51)29(46)35(58-26)43-24-42-28-32(37)40-23-41-33(28)43/h23-24,26,29-31,35,46-47H,4-22H2,1-3H3,(H,38,45)(H,39,48)(H,52,53)(H,54,55)(H2,37,40,41)(H2,49,50,51)/t26-,29-,30-,31?,35-/m1/s1

Upstream product

• 70243-14-0 1-bromo-pentadecan-2-one 
• 900498-43-3 coenzyme A 
• 124-06-1 Ethyl myristate 

Relevant articles and documents

Synthesis and Inhibitory Activity of Difluoroketone Substrate Analogs of N-Myristoyltransferase

Two fluorinatednonhydrolyzable analogs of myristoyl-coenzyme A were synthesized and tested for inhibitory activity against N-myristoyltransferase (NMT).S-(2,2-Difluoro-3-oxohexadecyl)-coenzyme A (3) and S-(3,3-difluoro-2-oxopentadecyl)-coenzyme A (2) were prepared by alkylation of coenzyme A and were purified by reverse phase chromatography.Inhibition of NMT was observed with 3 and 2, with IC50's of 110 nM and 80 nM, respectively, in an in vitro assay developed in our laboratory.The known unfluorinated analog S-(2-oxopentadecyl)-coenzyme A (1) was found to have an IC50 of 7 nM.At 100 μM in D2O, 3 was 59percent hydrated and 2 was 88percent hydrated.