Structure Database (LMSD)

Common Name
Stearidonic acid
Systematic Name
6Z,9Z,12Z,15Z-octadecatetraenoic acid
Synonyms
  • Moroctic acid
  • C18:4n-3,6,9,12
  • Morotic acid
LM ID
LMFA01030357
Status
Active
Exact Mass
Calculate m/z
276.20893
Formula
Abbrev




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MDLMOL SDF CSV TSV
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Main

Classification

String Representations

InChiKey (Click to copy)
JIWBIWFOSCKQMA-LTKCOYKYSA-N
InChi (Click to copy)
InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10,12-13H,2,5,8,11,14-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-,13-12-
SMILES (Click to copy)
C(CCCC/C=C\C/C=C\C/C=C\C/C=C\CC)(=O)O

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

Other Databases

Wikipedia
LIPIDAT ID
5676
KEGG ID
HMDB ID
CHEBI ID
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 324.34
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 5.44
Molar Refractivity 86.81

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Created at
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Updated at
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