Structure database (LMSD)

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LM IDLMFA08040020
Common NameN-(5Z,8Z,11Z,14Z-heneicosatetraenoyl)-ethanolamine
Systematic NameN-(5Z,8Z,11Z,14Z-heneicosatetraenoyl)-ethanolamine
Synonyms5,8,11,14-all-cis-heneicosatetraenoylethanolamine
Exact Mass
361.2981 (neutral)    Calculate m/z:
FormulaC23H39NO2
CategoryFatty Acyls [FA]
Main ClassFatty amides [FA08]
Sub ClassN-acyl ethanolamines (endocannabinoids) [FA0804]
Alternative ClassesUnsaturated fatty acids[FA0103], Hydroxy fatty acids[FA0105]
LIPIDBANK IDXPR7072
PubChem CID5283459
InChIKeyORVHRBKYJKEGFB-ZKWNWVNESA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C23H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(26)24-
21-22-25/h7-8,10-11,13-14,16-17,25H,2-6,9,12,15,18-22H2,1H3,(H,24,26)/b8-7-,11-1
0-,14-13-,17-16-
SMILESC(/C/C=C\C/C=C\CCCCCC)=C/C/C=C\CCCC(=O)NCCO
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms26Rings0Aromatic Rings0Rotatable Bonds17
 van der Waals
Molecular Volume
421.84Topological Polar
Surface Area
49.33Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP6.20Molar
Refractivity
114.10