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CAS 112989-00-1

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3-(hexadecanoylamino)-2-methoxypropyl 2-(trimethylammonio)ethyl phosphate

Description:
3-(Hexadecanoylamino)-2-methoxypropyl 2-(trimethylammonio)ethyl phosphate, with the CAS number 112989-00-1, is a synthetic amphiphilic compound characterized by its dual hydrophilic and hydrophobic properties. This molecule features a long-chain fatty acid (hexadecanoyl) that contributes to its lipophilicity, while the trimethylammonioethyl group imparts a positive charge, enhancing its solubility in aqueous environments. The methoxypropyl group adds steric bulk and can influence the compound's interaction with biological membranes. This substance is often studied for its potential applications in drug delivery systems, particularly in the formulation of liposomes or micelles, where its ability to encapsulate hydrophobic drugs while remaining soluble in water is advantageous. Additionally, its phospholipid-like structure suggests potential roles in cellular membrane dynamics and interactions. Overall, the unique combination of hydrophobic and hydrophilic characteristics makes it a valuable compound in biochemistry and pharmaceutical research.
Formula:C25H53N2O6P
InChI:InChI=1/C25H53N2O6P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)26-22-24(31-5)23-33-34(29,30)32-21-20-27(2,3)4/h24H,6-23H2,1-5H3,(H-,26,28,29,30)
SMILES:CCCCCCCCCCCCCCCC(=NCC(COP(=O)([O-])OCC[N+](C)(C)C)OC)O
Synonyms:
  • ethanaminium, 2-[[hydroxy[2-methoxy-3-[(1-oxohexadecyl)amino]propoxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt
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