Buy Online CAS Number 2260669-44-9 - TRC - 1-Pentadecanoyl-2-oleoyl(d7)-sn-glycero-3-phosphoinositol Ammonium | LGC Standards

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Product Overview

Product Code

TRC-P742334

CAS Number

Product Format

Neat

Molecular Formula

C42 H72 D7 O13 P . H3 N

Molecular Weight

847.13

Product Categories

Product Type

Stable Isotope Labelled

Product Information

Chemical Data

Analyte Name

1-Pentadecanoyl-2-oleoyl(D7)-sn-glycero-3-phosphoinositol (ammonium salt)

CAS Number

2260669-44-9

Molecular Formula

C42 H72 D7 O13 P . H3 N

Molecular Weight

847.13

Accurate Mass

846.6

SMILES

CCCCCCCCCCCCCCC(OC[C@H](COP(O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H]([C@H]1O)O)O)O)O)([O-])=O)OC(CCCCCCC/C=C\CCCCCC([2H])([2H])C([2H])([2H])C([2H])([2H])[2H])=O)=O.[NH4+]

InChI

InChI=1S/C42H79O13P.H3N/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-36(44)54-34(32-52-35(43)30-28-26-24-22-20-16-14-12-10-8-6-4-2)33-53-56(50,51)55-42-40(48)38(46)37(45)39(47)41(42)49;/h17-18,34,37-42,45-49H,3-16,19-33H2,1-2H3,(H,50,51);1H3/b18-17-;/t34-,37-,38-,39+,40-,41-,42-;/m1./s1/i1D3,3D2,5D2;

IUPAC

Ammonium (R)-2-(((Z)-octadec-9-enoyl-16,16,17,17,18,18,18-D7)oxy)-3-(pentadecanoyloxy)propyl ((1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl) phosphate

SIL Type

Deuterium

Product Data

Country of Origin

CANADA

Product Format

Neat

Product citations