Structure Database (LMSD)

Common Name
4Z,7Z-eicosadienoic acid
Systematic Name
4Z,7Z-eicosadienoic acid
Synonyms
  • delta4,7-20:2
LM ID
LMFA01031169
Status
Active
Exact Mass
Calculate m/z
308.27153
Formula
Abbrev


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MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
QDGZNZUMJYOGMO-AUGURXLVSA-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/h13-14,16-17H,2-12,15,18-19H2,1H3,(H,21,22)/b14-13-,17-16-
SMILES (Click to copy)
C(CC/C=C\C/C=C\CCCCCCCCCCCC)(=O)O

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Bathysiphon (#212484)
New and Uncommon Fatty Acids in Lipids of Deep-Sea Foraminifera.,
Lipids, 2017
Pubmed ID: 28210982

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

Reactions

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Reactions graph legend

Admin

Created at
22nd Oct 2019
Updated at
25th Apr 2022