Structure database (LMSD)

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LM IDLMFA08020013
Common NameN-amyl arachidohoyl amine
Systematic NameN-pentyl-5Z,8Z,11Z,14Z-eicosatetraenoyl amine
SynonymsN-amylarachidohoylamide
Exact Mass
373.3345 (neutral)    Calculate m/z:
FormulaC25H43NO
CategoryFatty Acyls [FA]
Main ClassFatty amides [FA08]
Sub ClassN-acyl amines [FA0802]
Alternative ClassesUnsaturated fatty acids[FA0103]
LIPIDBANK IDXPR7027
PubChem CID5283398
InChIKeyLLSIFHDREVFSBI-SNPVRQPZSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C25H43NO/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-25(27)26-2
4-22-6-4-2/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-
SMILESC(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCCC(=O)NCCCCC
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms27Rings0Aromatic Rings0Rotatable Bonds18
 van der Waals
Molecular Volume
447.65Topological Polar
Surface Area
29.10Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP7.72Molar
Refractivity
121.43