Structure database (LMSD)

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LM IDLMFA08040013
Common NamePalmitoyl-EA
Systematic NameN-hexadecanoyl-ethanolamine
SynonymsPalmitoyl ethanolamide; palmitoylethanolamide; Anandamide (16:0); N-palmitoyl
ethanolamine
Exact Mass
299.2824 (neutral)    Calculate m/z:
FormulaC18H37NO2
CategoryFatty Acyls [FA]
Main ClassFatty amides [FA08]
Sub ClassN-acyl ethanolamines (endocannabinoids) [FA0804]
Alternative ClassesHydroxy fatty acids[FA0105]
LIPIDBANK IDXPR7013
PubChem CID4671
HMDB IDHMDB0002100
SWISSLIPIDS IDSLM:000000149
CAYMAN ID90350
InChIKeyHXYVTAGFYLMHSO-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)19-16-17-20/h20H,2
-17H2,1H3,(H,19,21)
SMILESC(CCCCCCCCCCCCCC)C(=O)NCCO
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms21Rings0Aromatic Rings0Rotatable Bonds16
 van der Waals
Molecular Volume
345.90Topological Polar
Surface Area
49.33Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
2
 logP5.15Molar
Refractivity
91.39