Structure Database (LMSD)

Common Name
N-(2-fluoro-ethyl) 2-methyl-arachidonoyl amine
Systematic Name
N-(2-fluoro-ethyl)-2-methyl-5Z,8Z,11Z,14Z-eicosatetraenoyl amine
Synonyms
  • N-(2-fluoro-ethyl)2-methylarachidonoylamide
  • 2-methylarachidonoyl-(2'-fluoroethyl)amide
LM ID
LMFA08020056
Formula
C23H38NOF
Exact Mass
Calculate m/z
363.293742
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]
Unsaturated fatty acids [FA0103]
Branched fatty acids [FA0102]
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)
HMMNZALKMVCHHZ-ZKWNWVNESA-N
InChi (Click to copy)
InChI=1S/C23H38FNO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2)23(26)25-21-20-24/h7-8,10-11,13-14,16-17,22H,3-6,9,12,15,18-21H2,1-2H3,(H,25,26)/b8-7-,11-10-,14-13-,17-16-
SMILES (Click to copy)
C(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCC(C)C(=O)NCCF

Other Databases

LIPIDBANK ID
XPR7070
PubChem CID
5283437
Cayman ID
90055

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 419.12
Topological Polar Surface Area 29.10
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.03
Molar Refractivity 112.92

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Created at
-
Updated at
9th Apr 2021