Structure Database (LMSD)

Common Name
13,23-Dimethylnonatriacontane
Systematic Name
13,23-Dimethylnonatriacontane
Synonyms
LM ID
LMFA11000254
Formula
C41H84
Exact Mass
Calculate m/z
576.657301
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

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Oncopeltus fasciatus (#7536)
Insecta (#50557)
Cuticular hydrocarbons of the milkweed bug, Oncopeltus fasciatus by age and sex,
Insect Biochem, 1983

String Representations

InChiKey (Click to copy)
NPYHVUMUUATEDO-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C41H84/c1-5-7-9-11-13-15-17-18-19-20-22-25-29-33-37-41(4)39-35-31-27-23-26-30-34-38-40(3)36-32-28-24-21-16-14-12-10-8-6-2/h40-41H,5-39H2,1-4H3
SMILES (Click to copy)
CCCCCCCCCCCCC(C)CCCCCCCCCC(C)CCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430393

Calculated Physicochemical Properties

Heavy Atoms 41
Rings 0
Aromatic Rings 0
Rotatable Bonds 36
Van der Waals Molecular Volume 717.86
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 15.95
Molar Refractivity 191.27

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Created at
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Updated at
16th Dec 2025