Structure Database (LMSD)

Common Name
5,9-Nonacosadiene
Systematic Name
5,9-Nonacosadiene
Synonyms
LM ID
LMFA11000453
Formula
C29H56
Exact Mass
Calculate m/z
404.438201
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
Drosophila subquinaria (#198725)
Insecta (#50557)
Epicuticular compounds of Drosophila subquinaria and D. recens: identification, quantification, and their role in female mate choice.,
J Chem Ecol, 2013
Pubmed ID: 23604703

String Representations

InChiKey (Click to copy)
RRDKJAQURBRDKI-QNBOAHBYSA-N
InChi (Click to copy)
InChI=1S/C29H56/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h9,11,17,19H,3-8,10,12-16,18,20-29H2,1-2H3/b11-9+,19-17+
SMILES (Click to copy)
CCCC/C=C/CC/C=C/CCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
56936191

Calculated Physicochemical Properties

Heavy Atoms 29
Rings 0
Aromatic Rings 0
Rotatable Bonds 24
Van der Waals Molecular Volume 504.98
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 11.11
Molar Refractivity 135.82

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Created at
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Updated at
15th Dec 2025