Structure Database (LMSD)
Common Name
18-Hydroxylinoleic acid
Systematic Name
18-hydroxyoctadeca-9Z,12Z-dienoic acid
Synonyms
- omega-hydroxylinoleic acid
- 18-HODE
3D model of 18-Hydroxylinoleic acid
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
KPBOLLJJMHIJPH-PQZOIKATSA-N
InChi (Click to copy)
InChI=1S/C18H32O3/c19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18(20)21/h1-2,5,7,19H,3-4,6,8-17H2,(H,20,21)/b2-1-,7-5-
SMILES (Click to copy)
C(CCCCCCC/C=C\C/C=C\CCCCCO)(=O)O
References
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Arabidopsis thaliana
(#3702)
Magnoliopsida
(#3398)
Analysis of the aliphatic monomer composition of polyesters associated with Arabidopsis epidermis: occurrence of octadeca-cis-6, cis-9-diene-1,18-dioate as the major component.,
Plant J, 2004
Plant J, 2004
Pubmed ID:
15584957
Homo sapiens
(#9606)
Mammalia
(#40674)
Requirement for omega and (omega;-1)-hydroxylations of fatty acids by human cytochromes P450 2E1 and 4A11.,
J Lipid Res, 1999
J Lipid Res, 1999
Pubmed ID:
10553002
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
21
Rings
Aromatic Rings
Rotatable Bonds
15
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
Admin
Created at
18th Jan 2023
Updated at
18th Jan 2023