Structure database (LMSD)

  MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".
LM IDLMFA11000003
Common Nameheptadecane (W)
Systematic Nameheptadecane
Synonymsn-Heptadecane
Exact Mass
240.2817 (neutral)    Calculate m/z:
FormulaC17H36
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID12398
KEGG IDC01816
HMDB IDHMDB0059830
CHEBI ID16148
InChIKeyNDJKXXJCMXVBJW-UHFFFAOYSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3
SMILESC(CCCCCCCC)CCCCCCCC
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms17Rings0Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
302.66Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP6.88Molar
Refractivity
80.60