Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000037
Common Name4,8-Dimethyl-1,3E,7-nonatriene
Systematic Name4,8-Dimethyl-1,3E,7-nonatriene
Synonyms-
Exact Mass
150.1409 (neutral)    Calculate m/z:
FormulaC11H18
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID6427110
HMDB IDHMDB0035792
InChIKeyLUKZREJJLWEWQM-YRNVUSSQSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C11H18/c1-5-7-11(4)9-6-8-10(2)3/h5,7-8H,1,6,9H2,2-4H3/b11-7+
SMILESC=C/C=C(\C)/CC/C=C(\C)/C
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms11Rings0Aromatic Rings0Rotatable Bonds4
 van der Waals
Molecular Volume
190.94Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP3.87Molar
Refractivity
52.62