Structure Database (LMSD)

Common Name
2Z,5Z,8Z,11Z-Hexadecatetraenoic acid
Systematic Name
2Z,5Z,8Z,11Z-Hexadecatetraenoic acid
Synonyms
  • Z,Z,Z,Z-2,5,8,11-Hexadecatetraenoic acid
LM ID
LMFA01031073
Formula
C16H24O2
Exact Mass
Calculate m/z
248.17763
Sum Composition
FA 16:4
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

String Representations

InChiKey (Click to copy)
KKUJZJATEHIVBG-AFSLFLIVSA-N
InChi (Click to copy)
InChI=1S/C16H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h5-6,8-9,11-12,14-15H,2-4,7,10,13H2,1H3,(H,17,18)/b6-5-,9-8-,12-11-,15-14-
SMILES (Click to copy)
C(/C=C\C/C=C\C/C=C\C/C=C\CCCC)(=O)O

Other Databases

PubChem CID
131839761
PlantFA ID
10538

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 10
Van der Waals Molecular Volume 289.74
Topological Polar Surface Area 37.3
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 4.66
Molar Refractivity 77.57

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Created at
-
Updated at
25th Apr 2022