Structure Database (LMSD)

Common Name
13,17-Dimethyl-1-tritriacontene
Systematic Name
13,17-Dimethyl-1-tritriacontene
Synonyms
LM ID
LMFA11000239
Formula
C35H70
Exact Mass
Calculate m/z
490.54775
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)
QJUBWUZGEIQQCQ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C35H70/c1-5-7-9-11-13-15-17-18-19-20-22-24-26-28-31-35(4)33-29-32-34(3)30-27-25-23-21-16-14-12-10-8-6-2/h6,34-35H,2,5,7-33H2,1,3-4H3
SMILES (Click to copy)
C=CCCCCCCCCCCC(C)CCCC(C)CCCCCCCCCCCCCCCC

Other Databases

CHEBI ID
165728
PubChem CID
56936149

Calculated Physicochemical Properties

Heavy Atoms 35
Rings 0
Aromatic Rings 0
Rotatable Bonds 30
Van der Waals Molecular Volume 611.42
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 13.39
Molar Refractivity 163.47

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Updated at
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