1-Heptadecanoyl-rac-glycerol - ≥98%(HPLC) , CAS No.5638-14-2

CAS: 5638-14-2 Cat. No.: H464951 Molecular Weight: 344.53

GRADE & PURITY ≥98%(HPLC)

Synonyms

JK7K7PLW5C | 2,3-dihydroxypropyl heptadecanoate | SCHEMBL2507785 | UNII-JK7K7PLW5C | 1-margaroyl-glycerol | AKOS028110735 | CHEBI:144339 | DTXSID20276028 | Heptadecanoin | 1-Heptadecanoyl-rac-glycerol, >=98% (HPLC) | MG 17:0 | Heptadecanoic acid, 2,3-dihy

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

Description

1-Heptadecanoyl-rac-glycerol (2,3-dihydroxypropyl heptadecanoate) is a monoglyceride. It has been identified as one of the lipophilic compounds present in the woods of the different eucalypt hybrids and in the extracts of wheat bran.1-Heptadecanoyl-rac-glycerol may be employed as an internal standard during the quantitative estimation of 2-arachidonoyl glycerol (2-AG) in tissue lipid extracts of overnight fasted mice by LC/MS (Liquid chromatography–mass spectrometry). It may be employed as a neutral lipid standard for the analysis of cellular neutral lipid (such as cholesterol, cholesterol esters, wax esters) by HPLC.Standard for the quantification and characterization of lipid mixtures

Specifications

Synonyms

JK7K7PLW5C | 2, 3-dihydroxypropyl heptadecanoate | SCHEMBL2507785 | UNII-JK7K7PLW5C | 1-margaroyl-glycerol | AKOS028110735 | CHEBI:144339 | DTXSID20276028 | Heptadecanoin | 1-Heptadecanoyl-rac-glycerol, >=98% (HPLC) | MG 17:0 | Heptadecanoic acid, 2, 3-dihy

Specifications & Purity

≥98%(HPLC)

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Action Type

INHIBITOR

Purity

≥98%(HPLC)

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCCCCCCC(=O)OCC(CO)O
• IUPAC Name: 2,3-dihydroxypropyl heptadecanoate
• InChIKey: SVUQHVRAGMNPLW-UHFFFAOYSA-N
• INCHI: 1S/C20H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(23)24-18-19(22)17-21/h19,21-22H,2-18H2,1H3
• Isomeric SMILES: CCCCCCCCCCCCCCCCC(=O)OCC(CO)O
• Molecular Weight: 344.53
• Reaxy-Rn: 1797757
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1797757&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Glycerolipids
      • Subclass Monoradylglycerols
        • Level5 Monoacylglycerols
          • Level6 1-monoacylglycerols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Glycerolipids
• Subclass: Monoradylglycerols
• Intermediate Tree Nodes: Monoacylglycerols
• Direct Parent: 1-monoacylglycerols
• Alternative Parents: Fatty acid esters Secondary alcohols Carboxylic acid esters 1,2-diols Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: 1-acyl-sn-glycerol - Fatty acid ester - Fatty acyl - 1,2-diol - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Primary alcohol - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Alcohol - Organic oxide - Organooxygen compound - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as 1-monoacylglycerols. These are monoacylglycerols containing a glycerol acylated at the 1-position.
• External Descriptors: Monoacylglycerols

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemical and Physical Properties

• Flash Point(°F): Not applicable
• Flash Point(°C): Not applicable
• Molecular Weight: 344.500 g/mol
• XLogP3: 6.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 19
• Exact Mass: 344.293 Da
• Monoisotopic Mass: 344.293 Da
• Topological Polar Surface Area: 66.800 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 268.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1