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Product Overview

Product Code

TRC-H942788

Product Format

Neat

Molecular Formula

C25 D3 H44 N O5

Molecular Weight

444.663

Product Categories

TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

851132-91-7

Documentation

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Product Information

Chemical Data

Analyte Name

3-Hydroxyoleylcarnitine-d3

Molecular Formula

C25 D3 H44 N O5

Molecular Weight

444.663

Accurate Mass

444.364

SMILES

[2H]C([2H])([2H])[N+](C)(C)C[C@@H](CC(=O)[O-])OC(=O)CC(O)CCCCC\C=C/CCCCCCCC

InChI

InChI=1S/C25H47NO5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(27)19-25(30)31-23(20-24(28)29)21-26(2,3)4/h12-13,22-23,27H,5-11,14-21H2,1-4H3/b13-12-/t22?,23-/m1/s1/i2D3

IUPAC

(3R)-4-[dimethyl(trideuteriomethyl)azaniumyl]-3-[(Z)-3-hydroxyoctadec-9-enoyl]oxybutanoate

Unlabelled CAS Number

851132-91-7

SIL Type

Deuterium

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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