Structure database (LMSD)

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LM IDLMFA08020015
Common NameN-(1,1-dimethyl-propyl) arachidonoyl amine
Systematic NameN-(1,1-dimethyl-propyl)-5Z,8Z,11Z,14Z-eicosatetraenoyl amine
SynonymsN-(1,1-dimethyl-propyl)arachidonoylamide
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], Branched fatty acids[FA0102]
LIPIDBANK IDXPR7029
PubChem CID5283400
InChIKeyLWMKFJMMWYARBR-AILJCPQKSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C25H43NO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(27)26-
25(3,4)6-2/h10-11,13-14,16-17,19-20H,5-9,12,15,18,21-23H2,1-4H3,(H,26,27)/b11-10
-,14-13-,17-16-,20-19-
SMILESC(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCCC(=O)NC(C)(C)CC
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms27Rings0Aromatic Rings0Rotatable Bonds16
 van der Waals
Molecular Volume
447.65Topological Polar
Surface Area
29.10Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP7.72Molar
Refractivity
121.43