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CAS 96687-23-9

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9-Octadecenoic acid (9Z)-, 1,1′-[(1R)-1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl] ester

Description:
9-Octadecenoic acid (9Z)-, 1,1′-[(1R)-1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl] ester, identified by CAS number 96687-23-9, is a complex chemical compound that features a long-chain fatty acid structure combined with a phosphonate moiety. This compound is characterized by its unsaturated fatty acid backbone, specifically containing a cis double bond at the ninth carbon position, which contributes to its fluidity and reactivity. The presence of the phosphonate group suggests potential applications in biochemistry and pharmaceuticals, particularly in drug delivery systems or as a biochemical probe. The hydroxyl and oxido functionalities indicate that it may participate in hydrogen bonding and other interactions, enhancing its solubility and reactivity in biological systems. Overall, this compound exemplifies the intersection of organic chemistry and biochemistry, with implications for various applications in medicinal chemistry and material science.
Formula:C42H80NO8P
InChI:InChI=1S/C42H80NO8P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43-3)51-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21,40,43H,4-17,22-39H2,1-3H3,(H,46,47)/b20-18-,21-19-/t40-/m1/s1
InChI key:InChIKey=LPXFOQGBESUDAX-NLEYBKGJSA-N
SMILES:[C@@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)(COC(CCCCCCC/C=C\CCCCCCCC)=O)COP(OCCNC)(=O)O
Synonyms:
  • 1,2-Dioleoyl-sn-glycero-3-phosphoethanolamine-N-methyl
  • 9-Octadecenoic acid (9Z)-, 1,1′-[(1R)-1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl] ester
  • 9-Octadecenoic acid (9Z)-, 1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, (R)-
  • 9-Octadecenoic acid (Z)-, 1-(3-hydroxy-3-oxido-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, (R)-
  • 9-Octadecenoic acid (Z)-, 1-(3-hydroxy-2,4-dioxa-7-aza-3-phosphaoct-1-yl)-1,2-ethanediyl ester, P-oxide, (R)-
Found 1 products.