Structure Database (LMSD)

Common Name
5,9-Dimethylpentacosane
Systematic Name
5,9-Dimethylpentacosane
Synonyms
LM ID
LMFA11000449
Formula
C27H56
Exact Mass
Calculate m/z
380.438201
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
Metoecus paradoxus (#433052)
Insecta (#50557)
Chemical Strategies of the Beetle Metoecus Paradoxus, Social Parasite of the Wasp Vespula Vulgaris.,
J Chem Ecol, 2015
Pubmed ID: 26615426

String Representations

InChiKey (Click to copy)
GXZSALJZSNWURJ-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C27H56/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-23-27(4)25-21-24-26(3)22-8-6-2/h26-27H,5-25H2,1-4H3
SMILES (Click to copy)
CCCCC(C)CCCC(C)CCCCCCCCCCCCCCCC

Other Databases

PubChem CID
527077

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 475.66
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 10.49
Molar Refractivity 126.63

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Created at
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Updated at
17th Dec 2025