Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
Structure viewing options:  Static Image   GGAKetcher   MarvinView Applet   JmolApplet   ChemDraw              (?)
LM IDLMFA03090007
Common Name14,15-HxA3 (11S)
Systematic Name11S-hydroxy-14S,15S-epoxy-5Z,8Z,12E-eicosatrienoic acid
Synonyms14,15-Hepoxilin A3 (11S)
Exact Mass
336.2301 (neutral)    Calculate m/z:
FormulaC20H32O4
CategoryFatty Acyls [FA]
Main ClassEicosanoids [FA03]
Sub ClassHepoxilins [FA0309]
Alternative classificationUnsaturated fatty acid; Hydroxy fatty acid; Epoxy fatty acid;
PubChem Substance ID (SID)123060291
METABOLOMICS ID-
KEGG ID-
HMDB ID-
YMDB ID-
CHEBI ID-
InChIKeyWLMZMBKVRPUYIG-CHDPIHKSSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI1S/C20H32O4/c1-2-3-9-13-18-19(24-18)16-15-17(21)12-10-7-5-4-6-8-11-14-20(22)23/h
4,6-7,10,15-19,21H,2-3,5,8-9,11-14H2,1H3,(H,22,23)/b6-4-,10-7-,16-15+/t17-,18-,1
9-/m0/s1
StatusActive
ReferencesBiosynthesis of 14,15-Hepoxilins in Human L1236 Hodgkin Lymphoma Cells and Eosinophils
?sa Brunnstrom, Mats Hamberg, William J. Griffiths, Bengt Mannervik and Hans-Erik Claesson
Lipids Volume 46, Number 1, 69-79
Calculated physicochemical properties (?):
 Heavy Atoms24Rings1Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
366.80Topological Polar
Surface Area
70.06Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
4
 logP5.26Molar
Refractivity
98.49    
View additional information for LMFA03090007

logo LIPID MAPS is funded by a grant from the National Institute of General Medical Sciences of the National Institutes of Health.