Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA05000053
Common Name6E,11Z-hexadecadien-1-ol
Systematic Name6E,11Z-hexadecadien-1-ol
Synonymshexadecan-6E,11Z-dien-1-ol
Exact Mass
238.2297 (neutral)    Calculate m/z:
FormulaC16H30O
CategoryFatty Acyls [FA]
Main ClassFatty alcohols [FA05]
Sub Class-
PubChem CID5283302
InChIKeyWMRACIRVMYLKCN-GWZUCBFCSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,10-11,17H,2-4,7
-9,12-16H2,1H3/b6-5-,11-10+
SMILESC(/C=C\CCCC)CC/C=C/CCCCCO
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms17Rings0Aromatic Rings0Rotatable Bonds12
 van der Waals
Molecular Volume
288.87Topological Polar
Surface Area
20.23Hydrogen
Bond Donors
1Hydrogen
Bond Acceptors
1
 logP5.30Molar
Refractivity
77.70