Structure Database (LMSD)
Common Name
17-Hydroxylinoleic acid
Systematic Name
17-hydroxyoctadeca-9Z,12Z-dienoic acid
Synonyms
- 17-HODE
3D model of 17-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)
PLKBLKWFUGXKDQ-YXRHTCTQSA-N
InChi (Click to copy)
InChI=1S/C18H32O3/c1-17(19)15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18(20)21/h2-3,7,9,17,19H,4-6,8,10-16H2,1H3,(H,20,21)/b3-2-,9-7-
SMILES (Click to copy)
C(CCCCCCC/C=C\C/C=C\CCCC(O)C)(=O)O
References
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
Admin
Created at
18th Jan 2023
Updated at
18th Jan 2023