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16:1 (n7) Coenzyme A ammonium salt

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Category	Acyl CoA - Saturated Fatty Acid
Catalog NO.	BPG-3065
Product Name	16:1 (n7) Coenzyme A ammonium salt
CAS	1246304-41-5
Molecular Formula	C37H73N10O17P3S
Molecular Weight	1055.02

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Product Information

Description	16:1 (n7) Coenzyme A ammonium salt, a vital catalyst in fatty acid metabolism, contributes significantly to the therapeutic management of lipid metabolism dysfunctions and fatty acid oxidation anomalies. Moreover, its utility extends to pharmaceutical advancements aimed at combating metabolic conditions like obesity and diabetes.
Synonyms	palmitoleoyl Coenzyme A (ammonium salt); (9Z-hexadecenoyl) Coenzyme A (ammonium salt)
IUPAC Name	S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (Z)-hexadec-9-enethioate;azane
Canonical SMILES	CCCCCCC=CCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O.N.N.N
InChI	InChI=1S/C37H64N7O17P3S.3H3N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)65-21-20-39-27(45)18-19-40-35(49)32(48)37(2,3)23-58-64(55,56)61-63(53,54)57-22-26-31(60-62(50,51)52)30(47)36(59-26)44-25-43-29-33(38)41-24-42-34(29)44;;;/h9-10,24-26,30-32,36,47-48H,4-8,11-23H2,1-3H3,(H,39,45)(H,40,49)(H,53,54)(H,55,56)(H2,38,41,42)(H2,50,51,52);3*1H3/b10-9-;;;/t26-,30-,31-,32+,36-;;;/m1.../s1
InChIKey	BZLFGTFLKXOWRJ-SZUAKDMZSA-N
Purity	>99%
Related CAS	18198-76-0 (free acid)
Appearance	Powder
Shelf Life	1 Year
Storage	Store at -20°C
Exact Mass	1054.409
Hygroscopic	No
Light Sensitive	No
Percent Composition	C 42.12%, H 6.97%, N 13.28%, O 25.78%, P 8.81%, S 3.04%

References

1. Nam JW, Jenkins LM, Li J, Evans B, Jaworski JG, Allen DK. A General Method for Quantification and Discovery of Acyl Groups Attached to Acyl Carrier Proteins in Fatty Acid Metabolism using LC-MS/MS. Plant Cell. 2020 Feb 14:tpc.00954.2019. doi: 10.1105/tpc.19.00954. Epub ahead of print. PMID: 32060179. PubMed ID: 32060179.
2. Sampath H, Ntambi JM. Role of stearoyl-CoA desaturase-1 in skin integrity and whole body energy balance. J Biol Chem. 2014 Jan 31;289(5):2482-8. doi: 10.1074/jbc.R113.516716. Epub 2013 Dec 19. PMID: 24356954; PMCID: PMC3908384. PubMed ID: 24356954.

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