Structure Database (LMSD)

O N H
Common Name
N-amyl arachidohoyl amine
Systematic Name
N-pentyl-5Z,8Z,11Z,14Z-eicosatetraenoyl amine
Synonyms
  • N-amylarachidohoylamide
LM ID
LMFA08020013
Formula
C25H43NO
Exact Mass
Calculate m/z
373.334464
Sum Composition
NA 25:4
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

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]

String Representations

InChiKey (Click to copy)
LLSIFHDREVFSBI-SNPVRQPZSA-N
InChi (Click to copy)
InChI=1S/C25H43NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25(27)26-24-22-6-4-2/h9-10,12-13,15-16,18-19H,3-8,11,14,17,20-24H2,1-2H3,(H,26,27)/b10-9-,13-12-,16-15-,19-18-
SMILES (Click to copy)
C(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCCC(=O)NCCCCC

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

Other Databases

LIPIDBANK ID
XPR7027
PubChem CID
5283398

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 18
Van der Waals Molecular Volume 447.65
Topological Polar Surface Area 29.10
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 7.72
Molar Refractivity 121.43

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Updated at
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