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CAS 1628353-01-4

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D-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxohexadecyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), sodium salt (1:3)

Description:
D-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxohexadecyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), sodium salt (1:3) is a complex phospholipid derivative characterized by its inositol backbone, which is a cyclic sugar alcohol. This compound features multiple phosphate groups, contributing to its hydrophilic properties, while the long-chain fatty acid moieties (hexadecyl) provide hydrophobic characteristics, making it amphiphilic. The presence of sodium ions indicates that it is a salt form, enhancing its solubility in aqueous environments. This compound is likely to play a role in cellular signaling and membrane dynamics due to its structural properties. Its unique configuration may also suggest potential applications in drug delivery systems or as a surfactant in various biochemical processes. The specific stereochemistry and functional groups present in this molecule contribute to its biological activity and interactions within cellular systems. Overall, this compound exemplifies the intricate relationship between structure and function in biochemical substances.
Formula:C41H82NaO19P3
InChI:InChI=1S/C41H81O19P3.3Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)55-31-33(57-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-56-63(53,54)60-39-36(44)37(45)40(58-61(47,48)49)41(38(39)46)59-62(50,51)52;;;/h33,36-41,44-46H,3-32H2,1-2H3,(H,53,54)(H2,47,48,49)(H2,50,51,52);;;/q;3*+1/p-3/t33-,36-,37+,38+,39-,40-,41-;;;/m1.../s1
InChI key:STJBVCQNLFXTFJ-QNYQTKJTSA-K
SMILES:CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O)OP(=O)(O)[O-])OP(=O)(O)[O-])O)O)OC(=O)CCCCCCCCCCCCCCC.[Na+].[Na+].[Na+]
Synonyms:
  • D-myo-Inositol, 1-[(2R)-2,3-bis[(1-oxohexadecyl)oxy]propyl hydrogen phosphate] 4,5-bis(dihydrogen phosphate), sodium salt (1:3)
Found 3 products.