1,2-Dipalmitoyl-rac-glycerol - ≥98% , CAS No.40290-32-2

CAS: 40290-32-2 Cat. No.: D465504 Molecular Weight: 568.91 Beilstein Registry Number: 1809777 EC Number: 254-870-3

GRADE & PURITY ≥98%

Synonyms

(+)-D-Dipalmitin | (2-hexadecanoyloxy-3-hydroxypropyl) hexadecanoate | 2-Hydroxy-1-[(palmitoyloxy)methyl]ethyl palmitate # | 1,2-dihexadecanoyl-rac-glycerol | FT-0763033 | 1,2-dihexadecanoylglycerol | DG(16:0_16:0) | D-6002 | methyl (1R,3S)-3-aminocyclope

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

Product Describtion:

1,2-Dipalmitoylglycerol is an analog of the protein kinase C (PKC)-activating second messenger diacylglycerol. 1,2-Dipalmitoyl-sn-glycerol is a weak activator of PKC.

Specifications

Synonyms

(+)-D-Dipalmitin | (2-hexadecanoyloxy-3-hydroxypropyl) hexadecanoate | 2-Hydroxy-1-[(palmitoyloxy)methyl]ethyl palmitate # | 1, 2-dihexadecanoyl-rac-glycerol | FT-0763033 | 1, 2-dihexadecanoylglycerol | DG(16:0_16:0) | D-6002 | methyl (1R, 3S)-3-aminocyclope

Specifications & Purity

≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

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

Purity

≥98%

Product Properties

• pKa: pKa: 13.69 (Predicted)

Names and Identifiers

• Pubchem Sid: 488187200
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187200
• Canonical Smiles: CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC
• IUPAC Name: (2-hexadecanoyloxy-3-hydroxypropyl) hexadecanoate
• InChIKey: JEJLGIQLPYYGEE-UHFFFAOYSA-N
• INCHI: 1S/C35H68O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(37)39-32-33(31-36)40-35(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36H,3-32H2,1-2H3
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCCCCCCCCCC
• WGK Germany: 1
• Molecular Weight: 568.91
• Beilstein: 1809777
• Reaxy-Rn: 1730210
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730210&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Glycerolipids
      • Subclass Diradylglycerols
        • Level5 Diacylglycerols
          • Level6 1,2-diacylglycerols

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

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

Mechanisms of Action

Chemical and Physical Properties

• Refractive Index: n20D1.47 (Predicted)
• Boil Point(°C): ~620.8° C at 760 mmHg (Predicted)
• Melt Point(°C): 64-66° C (lit.)
• Molecular Weight: 568.900 g/mol
• XLogP3: 14.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 34
• Exact Mass: 568.507 Da
• Monoisotopic Mass: 568.507 Da
• Topological Polar Surface Area: 72.800 Ų
• Heavy Atom Count: 40
• Formal Charge: 0
• Complexity: 536.000
• 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