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860453C

Avanti

16:0-d31-18:1 PA

Name: 16:0-d31-18:1 PA
Brand: AVANTI

Avanti Research^™ - A Croda Brand

Synonym(s):

110920

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About This Item

Empirical Formula (Hill Notation):

C₃₇H₃₉O₈PNaD₃₁

CAS Number:

474943-59-4

Molecular Weight:

728.10

MDL number:

MFCD22416654

UNSPSC Code:

12352100

NACRES:

NA.25

Assay:

>99% (TLC)

Form:

liquid

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Properties

Product Name

16:0-d31-18:1 PA, 1-palmitoyl-d31-2-oleoyl-sn-glycero-3-phosphate (sodium salt), chloroform

assay

>99% (TLC)

form

liquid

packaging

pkg of 1 × 1 mL (860453C-10mg)

manufacturer/tradename

Avanti Research^™ - A Croda Brand 860453C

concentration

10 mg/mL (860453C-10mg)

shipped in

dry ice

storage temp.

−20°C

SMILES string

[H][C@@](COP(O)([O-])=O)(OC(CCCCCCC/C=C\CCCCCCCC)=O)COC(C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]

InChI

1S/C37H71O8P.Na/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(39)45-35(34-44-46(40,41)42)33-43-36(38)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2;/h17-18,35H,3-16,19-34H2,1-2H3,(H2,40,41,42);/q;+1/p-1/b18-17-;/t35-;/m1./s1/i2D3,4D2,6D2,8D2,10D2,12D2,14D2,16D2,19D2,21D2,23D2,25D2,27D2,29D2,31D2;

InChI key

PPYXMAJBOKWTQX-VYSSPCEXSA-M

Description

General description

Deuterated fatty acids experience exchange of the deuteriums on the alpha carbon to the carbonyl, i.e., C2 position, and will therefore be a mixture of compounds that are fully deuterated and partially deuterated at that position.

Application

16:0-d31-18:1 PA has been used as an internal standard to quantify fatty acid methyl esters (FAMES) using electrospray ionization tandem mass spectrometry (ESI-MS/MS)-based lipidomic analysis.

Packaging

5 mL Clear Glass Sealed Ampule (860453C-10mg)

Legal Information

Avanti Research is a trademark of Avanti Polar Lipids, LLC

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pictograms

GHS06,GHS08

signalword

Danger

hcodes

H302,H315,H319,H331,H336,H351,H361d,H372,H412

pcodes

P201 - P273 - P301 + P312 + P330 - P302 + P352 - P304 + P340 + P311 - P308 + P313

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Aquatic Chronic 3 - Carc. 2 - Eye Irrit. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 1 - STOT SE 3

target_organs

Central nervous system, Liver,Kidney

wgk

WGK 3

Storage Class

6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects

flash_point_f

does not flash

flash_point_c