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pacFA-18:1 PC

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Category	Standards
Catalog NO.	BPG-3131
Product Name	pacFA-18:1 PC
CAS	2260670-75-3
Molecular Formula	C41H74N3O8P
Molecular Weight	768.02

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Product Information

Description	pacFA-18:1 PC is a phosphatidylcholine (PC) molecule containing a palmitoleic acid fatty acid chain with 18 carbons and 1 double bond. It plays a role in cell membrane structure and function and has potential applications in lipid metabolism and cardiovascular disease research.
Synonyms	1-(9-(3-pent-4-ynyl-3-H-diazirin-3-yl)-nonanoyl)-2-oleoyl-sn-glycero-3-phosphocholine; (2R)-2-[(9Z)-9-Octadecenoyloxy]-3-({9-[3-(4-pentyn-1-yl)-3H-diaziren-3-yl]nonanoyl}oxy)propyl 2-(trimethylammonio)ethyl phosphate; Ethanaminium, 2-[[hydroxy[(2R)-2-[[(9Z)-1-oxo-9-octadecen-1-yl]oxy]-3-[[1-oxo-9-[3-(4-pentyn-1-yl)-3H-diazirin-3-yl]nonyl]oxy]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt
IUPAC Name	[(2R)-2-[(Z)-octadec-9-enoyl]oxy-3-[9-(3-pent-4-ynyldiazirin-3-yl)nonanoyloxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
Canonical SMILES	CCCCCCCCC=CCCCCCCCC(=O)OC(COC(=O)CCCCCCCCC1(N=N1)CCCC#C)COP(=O)([O-])OCC[N+](C)(C)C
InChI	InChI=1S/C41H74N3O8P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-24-27-31-40(46)52-38(37-51-53(47,48)50-35-34-44(3,4)5)36-49-39(45)30-26-23-21-22-25-29-33-41(42-43-41)32-28-9-7-2/h2,15-16,38H,6,8-14,17-37H2,1,3-5H3/b16-15-/t38-/m1/s1
InChIKey	MZZDOXWHMLEPLR-FZMBPTIQSA-N
Purity	>95%
Appearance	White Solid
Shelf Life	1 Year
Storage	Store at -80°C
Exact Mass	767.521
Hygroscopic	No
Light Sensitive	No
Percent Composition	C 64.12%; H 9.71%; N 5.47%; O 16.67%; P 4.03%

References

1. Haberkant P, Holthuis JC. Fat & fabulous: bifunctional lipids in the spotlight. Biochim Biophys Acta. 2014 Aug;1841(8):1022-30. doi: 10.1016/j.bbalip.2014.01.003. Epub 2014 Jan 15. PMID: 24440797. PubMed ID: 24440797.
2. Haberkant P, Raijmakers R, Wildwater M, Sachsenheimer T, Brügger B, Maeda K, Houweling M, Gavin AC, Schultz C, van Meer G, Heck AJ, Holthuis JC. In vivo profiling and visualization of cellular protein-lipid interactions using bifunctional fatty acids. Angew Chem Int Ed Engl. 2013 Apr 2;52(14):4033-8. doi: 10.1002/anie.201210178. Epub 2013 Feb 28. PMID: 23450850. PubMed ID: 23450850.

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