Structure Database (LMSD)
Common Name
Margaroyl-EA
Systematic Name
N-(Heptadecanoyl)-ethanolamine
Synonyms
- Margaroyl-ethanolamine
3D model of Margaroyl-EA
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Biological Context
Heptadecanoyl ethanolamide is a synthetic analog of PEA which incorporates an odd-numbered (17-carbon) fatty acid chain. This analog is unlikely to be present in any natural tissue, and so can be used as an internal standard for quantitative analysis. Heptadecanoyl ethanolamide potentiates the Ca2+ influx response to arachidonyl ethanolamide several fold in cells expressing human recombinant VR1.
This information has been provided by Cayman Chemical
References
String Representations
InChiKey (Click to copy)
GCCFMSAXQJECNH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C19H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(22)20-17-18-21/h21H,2-18H2,1H3,(H,20,22)
SMILES (Click to copy)
C(CCCCCCCCCCCCCCC)C(=O)NCCO
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
22
Rings
0
Aromatic Rings
0
Rotatable Bonds
17
Van der Waals Molecular Volume
363.20
Topological Polar Surface Area
49.33
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
logP
5.54
Molar Refractivity
96.00
Admin
Created at
-
Updated at
7th Feb 2024