Structure database (LMSD)

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LM IDLMFA11000038
Common Name13R-Methyl-6E-heneicosene
Systematic Name13R-Methyl-6E-heneicosene
Synonyms-
Exact Mass
308.3443 (neutral)    Calculate m/z:
FormulaC22H44
CategoryFatty Acyls [FA]
Main ClassHydrocarbons [FA11]
Sub Class-
PubChem CID56936060
InChIKeyCFLRHPQYBXOMBU-CHHLAKQQSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C22H44/c1-4-6-8-10-12-13-14-15-17-19-21-22(3)20-18-16-11-9-7-5-2/h12-13
,22H,4-11,14-21H2,1-3H3/b13-12+/t22-/m1/s1
SMILESCCCCC/C=C/CCCCC[C@H](C)CCCCCCCC
StatusActive
CommentsPherobase Semiochemicals
Calculated physicochemical properties (?):
 Heavy Atoms22Rings0Aromatic Rings0Rotatable Bonds17
 van der Waals
Molecular Volume
386.52Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP8.46Molar
Refractivity
103.52