RefMet Compound Details

MW structure4661 (View MW Metabolite Database details)
RefMet nameOleoyl-EA
Systematic nameN-(9Z-octadecenoyl)-ethanolamine
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)NCCO
Sum CompositionNAE 18:1 View other entries in RefMet with this sum composition
Exact mass325.298079 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC20H39NO2View other entries in RefMet with this formula
InChIInChI=1S/C20H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h9-10,22H,2-8,11-19H2,1H3,(H,21,23)/b10-9-
InChIKeyBOWVQLFMWHZBEF-KTKRTIGZSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassFatty Acyls
Main ClassFatty amides
Sub ClassNAE (N-acyl ethanolamines)
Pubchem CID5283454
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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