Structure Database (LMSD)

Common Name
20:2(5Z,15Z)
Systematic Name
5Z,15Z-eicosadienoic acid
Synonyms
  • C20:2n-5,15
LM ID
LMFA01030867
Formula
Exact Mass
Calculate m/z
308.27153
Sum Composition
Status
Curated

Classification

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

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Abyssogena phaseoliformis (#1871145)
Bivalvia (#6544)
Identification of novel n-4 series polyunsaturated fatty acids in a deep-sea clam, Calyptogena phaseoliformis.,
J Chromatogr A, 2007
Pubmed ID: 17604037

String Representations

InChiKey (Click to copy)
WNCXYEKUZJPVOH-NCCHCWSYSA-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/h5-6,15-16H,2-4,7-14,17-19H2,1H3,(H,21,22)/b6-5-,16-15-
SMILES (Click to copy)
C(CCC/C=C\CCCCCCCC/C=C\CCCC)(=O)O

Other Databases

CHEBI ID
PubChem CID

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