Structure Database (LMSD)

Common Name
7Z,10Z,13Z,16Z-eicosatraenoic acid
Systematic Name
7Z,10Z,13Z,16Z-eicosatraenoic acid
Synonyms
  • (7Z,10Z,13Z)-eicosa-7,10,13,16-tetraenoic acid
  • 20:4n-4
LM ID
LMFA03000020
Status
Active
Exact Mass
Calculate m/z
304.24023
Formula
Abbrev


Download as...
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)
QCPSKUPOPPPLSP-GJDCDIHCSA-N
InChi (Click to copy)
InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h4-5,7-8,10-11,13-14H,2-3,6,9,12,15-19H2,1H3,(H,21,22)/b5-4-,8-7-,11-10-,14-13-
SMILES (Click to copy)
C(CC/C=C\C/C=C\C/C=C\C/C=C\CCC)CCC(O)=O

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Mortierella alpina (#64518)
Mortierellomycetes (#2212732)
Polyunsaturated fatty acids production and transformation by Mortierella alpina and anaerobic bacteria,
Eur J Lipid Sci, 2012

Calculated Physicochemical Properties

Heavy Atoms 22
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 358.94
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.22
Molar Refractivity 96.04

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Created at
20th Jun 2019
Updated at
20th Jun 2019