Structure database (LMSD)

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LM IDLMFA08020022
Common NameN'-5Z,8Z,11Z,14Z-eicosatetraenoyl-N''-diethyl-ethylenediamine
Systematic NameN'-5Z,8Z,11Z,14Z-eicosatetraenoyl-N''-diethyl-ethylenediamine
SynonymsN'-arachidonoyl-N''-diethyl ethylene diamine; N'-arachidonoyl-N''-
diethylethylenediamine
Exact Mass
402.3610 (neutral)    Calculate m/z:
FormulaC26H46N2O
CategoryFatty Acyls [FA]
Main ClassFatty amides [FA08]
Sub ClassN-acyl amines [FA0802]
Alternative ClassesUnsaturated fatty acids[FA0103]
LIPIDBANK IDXPR7036
PubChem CID5283407
InChIKeyLOZCJJDEBAPQGP-AILJCPQKSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C26H46N2O/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(29)27
-24-25-28(5-2)6-3/h10-11,13-14,16-17,19-20H,4-9,12,15,18,21-25H2,1-3H3,(H,27,29)
/b11-10-,14-13-,17-16-,20-19-
SMILESC(/C/C=C\C/C=C\CCCCC)=C/C/C=C\CCCC(=O)NCCN(CC)CC
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms29Rings0Aromatic Rings0Rotatable Bonds19
 van der Waals
Molecular Volume
475.95Topological Polar
Surface Area
32.34Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP7.73Molar
Refractivity
131.16