Structure Database (LMSD)

Common Name
Oleic acid
Systematic Name
9Z-octadecenoic acid
Synonyms
  • 9-octadecylenic acid
  • cis-9-octadecenoic acid
  • cis-Oleic acid
  • cis-Oleate
  • Oleate
  • Elaic acid
  • Elaidoic acid
  • C18:1n-9
  • Rapinic acid
  • 9(Z)-OME
LM ID
LMFA01030002
Formula
Exact Mass
Calculate m/z
282.25588
Sum Composition
Status
Active



Main

Classification

String Representations

InChiKey (Click to copy)
ZQPPMHVWECSIRJ-KTKRTIGZSA-N
InChi (Click to copy)
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-
SMILES (Click to copy)
OC(=O)CCCCCCC/C=C\CCCCCCCC

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
KEGG ID
HMDB ID
CHEBI ID
LIPIDBANK ID
DFA0111
PubChem CID
PlantFA ID
SwissLipids ID
Cayman ID
PDB ID
GuidePharm ID

Calculated Physicochemical Properties

Heavy Atoms 20
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 332.26
Topological Polar Surface Area 37.30
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 2
logP 6.11
Molar Refractivity 87.09

Reactions

Filter by species:
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

Admin

Created at
-
Updated at
5th Jan 2023