myo-Inositol, 1-[(2R)-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate]

CAS Registry Number®

88587-96-6

CAS Name

myo-Inositol, 1-[(2R)-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate]

Molecular Formula

C45H83O13P

Molecular Mass

863.11

Cite this Page

myo-Inositol, 1-[(2R)-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate].   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=88587-96-6 (retrieved 2024-11-22) (CAS RN: 88587-96-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C45H83O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,37,40-45,48-52H,3-11,13,15-17,19,21-36H2,1-2H3,(H,53,54)

InChIKey

InChIKey=KZVRAFHIKMDULK-UHFFFAOYSA-N

SMILES

O(P(OCC(COC(CCCCCCCCCCCCCCCCC)=O)OC(CCCCCCCC=CCC=CCCCCC)=O)(=O)O)C1C(O)C(O)C(O)C(O)C1O

Canonical SMILES

O=C(OCC(OC(=O)CCCCCCCC=CCC=CCCCCC)COP(=O)(O)OC1C(O)C(O)C(O)C(O)C1O)CCCCCCCCCCCCCCCCC

Other Names for this Substance

  • myo-Inositol, 1-[(2R)-2-[[(9Z,12Z)-1-oxo-9,12-octadecadien-1-yl]oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate]
  • myo-Inositol, 1-[2-[(1-oxo-9,12-octadecadienyl)oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate], [R-(Z,Z)]-
  • myo-Inositol, 1-[(2R)-2-[[(9Z,12Z)-1-oxo-9,12-octadecadienyl]oxy]-3-[(1-oxooctadecyl)oxy]propyl hydrogen phosphate]

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