Structure Database (LMSD)

Common Name
11R-Hydroxylinoleic acid
Systematic Name
11R-hydroxyoctadeca-9Z,12Z-dienoic acid
Synonyms
  • 11R-HODE
LM ID
LMFA02000400
Formula
Exact Mass
Calculate m/z
296.235145
Sum Composition
Status
Active

Main

Classification

String Representations

InChiKey (Click to copy)
GIJZWHLTBMCTJV-LILDEJAOSA-N
InChi (Click to copy)
InChI=1S/C18H32O3/c1-2-3-4-8-11-14-17(19)15-12-9-6-5-7-10-13-16-18(20)21/h11-12,14-15,17,19H,2-10,13,16H2,1H3,(H,20,21)/b14-11-,15-12-/t17-/m1/s1
SMILES (Click to copy)
C(CCCCCCC/C=C\[C@H](O)/C=C\CCCCC)(=O)O

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Rattus norvegicus (#10116)
Mammalia (#40674)
Bis-allylic hydroxylation of polyunsaturated fatty acids by hepatic monooxygenases and its relation to the enzymatic and nonenzymatic formation of conjugated hydroxy fatty acids.,
Arch Biochem Biophys, 1993
Pubmed ID: 8424677
Lithothamnion corallioides (#1277934)
Florideophyceae (#2806)
Linoleic acid metabolism in the red algaLithothamnion corallioides: Biosynthesis of 11(R)-hydroxy-9(Z),12(Z)-octadecadienoic acid,
Lipids, 1992

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 21
Rings
Aromatic Rings
Rotatable Bonds 14
Van der Waals Molecular Volume 338.41
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 5.14
Molar Refractivity 88.90

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Created at
18th Jan 2023
Updated at
18th Jan 2023