Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA01030158
Common Namebishomo-γ-linolenic acid (W)
Systematic Name8Z,11Z,14Z-eicosatrienoic acid
Synonymsdihomo-γ-linolenic acid; 8, 11, 14-eicosatrienoic acid; C20:3n-6,9,12; γ-
Homolinolenic acid
Exact Mass
306.2559 (neutral)    Calculate m/z:
FormulaC20H34O2
CategoryFatty Acyls [FA]
Main ClassFatty Acids and Conjugates [FA01]
Sub ClassUnsaturated fatty acids [FA0103]
LIPIDBANK IDDFA0197
LIPIDAT ID1773
PubChem CID5280581
KEGG IDC03242
HMDB IDHMDB0002925
PlantFA ID10142
SWISSLIPIDS IDSLM:000000928
CAYMAN ID90230
InChIKeyHOBAELRKJCKHQD-QNEBEIHSSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7
,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
SMILESC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)(=O)O
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms22Rings0Aromatic Rings0Rotatable Bonds15
 van der Waals
Molecular Volume
361.58Topological Polar
Surface Area
37.30Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
2
 logP6.44Molar
Refractivity
96.13