Structure Database (LMSD)

Common Name
11,15,19-Trimethylheptatriacontane
Systematic Name
11,15,19-Trimethylheptatriacontane
Synonyms
LM ID
LMFA11000190
Formula
C40H82
Exact Mass
Calculate m/z
562.641651
Status
Curated
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)
BOKRAEHZMJFHRL-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C40H82/c1-6-8-10-12-14-16-17-18-19-20-21-22-23-25-27-29-33-39(4)35-31-37-40(5)36-30-34-38(3)32-28-26-24-15-13-11-9-7-2/h38-40H,6-37H2,1-5H3
SMILES (Click to copy)
CCCCCCCCCCC(C)CCCC(C)CCCC(C)CCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430365

Calculated Physicochemical Properties

Heavy Atoms 40
Rings 0
Aromatic Rings 0
Rotatable Bonds 34
Van der Waals Molecular Volume 700.56
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 15.42
Molar Refractivity 186.58

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Created at
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Updated at
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