Analyte Name

1-Pentadecanoyl-2-oleoyl(D7)-sn-glycero-3-phosphate (sodium salt)

CAS Number

2260669-46-1

Molecular Formula

C36 H61 D7 O8 P . Na

Molecular Weight

689.94

Accurate Mass

689.5

SMILES

O=C(O[C@@H](COP([O-])(O)=O)COC(CCCCCCCCCCCCCC)=O)CCCCCCC/C=C\CCCCCC([2H])([2H])C([2H])([2H])C([2H])([2H])[2H].[Na+]

InChI

InChI=1S/C36H69O8P.Na/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-36(38)44-34(33-43-45(39,40)41)32-42-35(37)30-28-26-24-22-20-16-14-12-10-8-6-4-2;/h17-18,34H,3-16,19-33H2,1-2H3,(H2,39,40,41);/q;+1/p-1/b18-17-;/t34-;/m1./s1/i1D3,3D2,5D2;

IUPAC

Sodium (R,Z)-2-((octadec-9-enoyl-16,16,17,17,18,18,18-d7)oxy)-3-(pentadecanoyloxy)propyl hydrogen phosphate

SIL Type

Deuterium

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat