Structure Database (LMSD)

Common Name
7Z,12Z-eicosadienoic acid
Systematic Name
7Z,12Z-eicosadienoic acid
Synonyms
  • delta7,12-20:2
LM ID
LMFA01031170
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
Bathysiphon (#212484)
New and Uncommon Fatty Acids in Lipids of Deep-Sea Foraminifera.,
Lipids, 2017
Pubmed ID: 28210982

String Representations

InChiKey (Click to copy)
DFOSYHMMYNIUTL-ZQQYBVFVSA-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/h8-9,13-14H,2-7,10-12,15-19H2,1H3,(H,21,22)/b9-8-,14-13-
SMILES (Click to copy)
C(CCCCC/C=C\CCC/C=C\CCCCCCC)(=O)O

Other Databases

PubChem CID
171119144

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

Admin

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