Structure Database (LMSD)

Common Name
11,14-eicosadienoic acid
Systematic Name
11,14-eicosadienoic acid
Synonyms
  • 11, 14-icosadienoic acid
  • C20:2n-6,9
LM ID
LMFA01030130
Formula
C20H36O2
Exact Mass
Calculate m/z
308.27153
Sum Composition
FA 20:2
Status
Active
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 graph legend

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Lipidomics reveals a remarkable diversity of lipids in human plasma,
J Lipid Res, 2010
Pubmed ID: 20671299

String Representations

InChiKey (Click to copy)
XSXIVVZCUAHUJO-AVQMFFATSA-N
InChi (Click to copy)
InChI=1S/C20H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10H,2-5,8,11-19H2,1H3,(H,21,22)/b7-6+,10-9+
SMILES (Click to copy)
C(/C=C/C/C=C/CCCCC)CCCCCCCCC(=O)O

Other Databases

CHEBI ID
194379
LIPIDBANK ID
DFA0169
PubChem CID
5282805

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 364.22
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.66
Molar Refractivity 96.23

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Created at
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Updated at
25th Apr 2022