Structure Database (LMSD)

Common Name
N-(2-methoxy-ethyl) arachidonoyl amine
Systematic Name
N-(2-methoxy-ethyl)-5Z,8Z,11Z,14Z-eicosatetraenoyl amine
Synonyms
  • N-(2-methoxy-ethyl)arachidonoylamide
LM ID
LMFA08020021
Formula
C23H39NO2
Exact Mass
Calculate m/z
361.298079
Sum Composition
NA 23:4;O
Status
Active
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]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
synthetic construct (#32630)
Structural requirements for binding of anandamide-type compounds to the brain cannabinoid receptor.,
J Med Chem, 1997
Pubmed ID: 9057852
synthetic construct (#32630)
Structural requirements for binding of anandamide-type compounds to the brain cannabinoid receptor.,
J Med Chem, 1997
Pubmed ID: 9057852

String Representations

InChiKey (Click to copy)
FPVXVIYZKXLTPR-GKFVBPDJSA-N
InChi (Click to copy)
InChI=1S/C23H39NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(25)24-22(2)26-3/h8-9,11-12,14-15,17-18,22H,4-7,10,13,16,19-21H2,1-3H3,(H,24,25)/b9-8-,12-11-,15-14-,18-17-
SMILES (Click to copy)
C(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCCC(=O)NC(OC)C

Other Databases

LIPIDBANK ID
XPR7035
PubChem CID
5283406

Calculated Physicochemical Properties

Heavy Atoms 26
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 421.84
Topological Polar Surface Area 38.33
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
logP 6.53
Molar Refractivity 113.53

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Created at
-
Updated at
5th Apr 2022