Structure Database (LMSD)

Common Name
3,7,11-Trimethylhentriacontane
Systematic Name
3,7,11-Trimethylhentriacontane
Synonyms
LM ID
LMFA11000372
Formula
C34H70
Exact Mass
Calculate m/z
478.547751
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)
FVYJAIJIAUBPDV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C34H70/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27-33(4)30-26-31-34(5)29-25-28-32(3)7-2/h32-34H,6-31H2,1-5H3
SMILES (Click to copy)
CCC(C)CCCC(C)CCCC(C)CCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
56936171

Calculated Physicochemical Properties

Heavy Atoms 34
Rings 0
Aromatic Rings 0
Rotatable Bonds 28
Van der Waals Molecular Volume 596.76
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 13.08
Molar Refractivity 158.88

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Created at
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Updated at
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