Structure Database (LMSD)

Common Name
9,10-Pentacosadiene
Systematic Name
9,10-Pentacosadiene
Synonyms
LM ID
LMFA11000535
Formula
C25H48
Exact Mass
Calculate m/z
348.375601
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View NP-MRD ID(NMR) spectrum

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Hydrocarbons [FA11]

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Antitrogus consanguineus (#272057)
Insecta (#50557)
A suite of novel allenes from Australian melolonthine scarab beetles. Structure, synthesis, and stereochemistry.,
J Org Chem, 2003
Pubmed ID: 12737550

String Representations

InChiKey (Click to copy)
DXBGJJXZTQSWTG-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C25H48/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h17,21H,3-16,18,20,22-25H2,1-2H3
SMILES (Click to copy)
CCCCCCCCC=C=CCCCCCCCCCCCCCC

Other Databases

PubChem CID
12124398

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 20
Van der Waals Molecular Volume 435.78
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 9.54
Molar Refractivity 116.34

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Created at
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Updated at
6th Jan 2026