CAS 946524-37-4

2-Hydroxy-1-(hydroxymethyl-d2)ethyl-1,2,2-d3 (9Z)-9-octadecenoate

Description:

2-Hydroxy-1-(hydroxymethyl-d2)ethyl-1,2,2-d3 (9Z)-9-octadecenoate, with CAS number 946524-37-4, is a deuterated derivative of a fatty acid ester. This compound features a long-chain unsaturated fatty acid moiety, specifically an octadecenoate, which indicates the presence of a double bond in the 9-position of the carbon chain. The presence of hydroxyl groups suggests that it has both hydrophilic and hydrophobic characteristics, making it amphiphilic. The deuterated labels (d2 and d3) indicate that certain hydrogen atoms in the molecule have been replaced with deuterium, which can be useful in studies involving nuclear magnetic resonance (NMR) spectroscopy or tracing metabolic pathways. This compound may be of interest in biochemical research, particularly in studies related to lipid metabolism, as well as in the development of pharmaceuticals or functional foods. Its unique isotopic composition can also enhance the understanding of its behavior in biological systems.

Formula: C₂₁H₃₅D₅O₄

InChI: InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-/i18D2,19D2,20D

InChI key: InChIKey=UPWGQKDVAURUGE-FNKKQMTJSA-N

SMILES: C(OC(CCCCCCC/C=C\CCCCCCCC)=O)(C(O)([2H])[2H])(C(O)([2H])[2H])[2H]

Synonyms:

• 9-Octadecenoic acid (9Z)-, 2-hydroxy-1-(hydroxymethyl-d2)ethyl-1,2,2-d3 ester
• 2-Oleoyl glycerol-d5
• 2-Hydroxy-1-(hydroxymethyl-d2)ethyl-1,2,2-d3 (9Z)-9-octadecenoate

2-Oleoyl Glycerol-d5

Controlled Product

CAS: 946524-37-4

Applications Labelled 2-Oleoylglycerol (O528020). A metabolite of 2-acylglycerol used as biomarker.
References Owen, M., et al.: Biochem. J., 323, 17 (1997), Waterman, I., et al.: J. Lipid Res., 43, 1555 (2002), Chon, S., et al.: J. Biol. Chem., 282, 33346 (2007),

Formula: C₂₁H₃₅D₅O₄

Color and Shape: Neat

Molecular weight: 361.57

Ref: TR-O528022