Structure database (LMSD)

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LM IDLMFA08010010
Common NamePalmitoleamide
Systematic Name9Z-hexadecenamide
Synonyms-
Exact Mass
253.2406 (neutral)    Calculate m/z:
FormulaC16H31NO
CategoryFatty Acyls [FA]
Main ClassFatty amides [FA08]
Sub ClassPrimary amides [FA0801]
Alternative ClassesUnsaturated fatty acids[FA0103], Amino fatty acids[FA0110]
PubChem CID56936054
InChIKeyYRPQTVNCCVPGFA-FPLPWBNLSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H31NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2
,1H3,(H2,17,18)/b8-7-
SMILESC(CCCCCCC(=O)N)/C=C\CCCCCC
StatusActive
ReferencesPrimary fatty acid amide metabolism:
conversion of fatty acids and an ethanolamine in N18TG2 and SCP cells
Emma K. Farrell, Yuden Chen, Muna Barazanji, Kristen A. Jeffries, Felipe Cameroamortegui, and David J. Merkler
J. Lipid Res. 2012 53:(2) 247-256.
Calculated physicochemical properties (?):
 Heavy Atoms18Rings0Aromatic Rings0Rotatable Bonds13
 van der Waals
Molecular Volume
299.87Topological Polar
Surface Area
43.09Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP4.73Molar
Refractivity
79.41