Structure Database (LMSD)

Common Name
N-(2-fluoro-ethyl)-eicosanoyl amine
Systematic Name
N-(2-fluoro-ethyl)-eicosanoyl amine
Synonyms
  • N-(2-fluoro-ethyl)-eicosanoyl amide
  • N-eicosanoyl-(2'-fluoroethyl)amine
LM ID
LMFA08020049
Formula
C22H44NOF
Exact Mass
Calculate m/z
357.340692
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty amides [FA08]
N-acyl amines [FA0802]
Fatty Acids and Conjugates [FA01]
Halogenated fatty acids [FA0109]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
synthetic construct (#32630)
Evaluation of cannabinoid receptor binding and in vivo activities for anandamide analogs.,
J Pharmacol Exp Ther, 1995
Pubmed ID: 7791088

String Representations

InChiKey (Click to copy)
DDRMSVFOQONMHK-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C22H44FNO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(25)24-21-20-23/h2-21H2,1H3,(H,24,25)
SMILES (Click to copy)
C(CCCCCCCCCCC)CCCCCCCC(=O)NCCF

Other Databases

LIPIDBANK ID
XPR7063
PubChem CID
5283430

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 20
Van der Waals Molecular Volume 412.38
Topological Polar Surface Area 29.10
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.68
Molar Refractivity 108.74

Admin

Created at
-
Updated at
9th Apr 2021