Structure Database (LMSD)

Common Name
3,7-Diethyl-11-methyltrideca-1,3,6,10-tetraene
Systematic Name
3,7-Diethyl-11-methyltrideca-1,3,6,10-tetraene
Synonyms
LM ID
LMFA11000381
Formula
C18H32
Exact Mass
Calculate m/z
248.2504
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
AMUXOEXEZZZMNW-GBHPYOBUSA-N
InChi (Click to copy)
InChI=1S/C18H32/c1-6-16(5)12-10-14-18(9-4)15-11-13-17(7-2)8-3/h12-13,15H,6-11,14H2,1-5H3/b16-12+,18-15+
SMILES (Click to copy)
CC/C(/CC)=C/C/C=C(\CC)/CC/C=C(\C)/CC

Other Databases

PubChem CID
56936174

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 9
Van der Waals Molecular Volume 312.04
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 6.60
Molar Refractivity 84.94

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Created at
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Updated at
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