Structure Database (LMSD)

Common Name
9-Methylnonacosane
Systematic Name
9-Methylnonacosane
Synonyms
LM ID
LMFA11000557
Formula
C30H62
Exact Mass
Calculate m/z
422.485151
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
Acheta domesticus (#6997)
Insecta (#50557)
Cuticular lipids of insects—VII Cuticular hydrocarbons of the crickets Achet a domesticus, gryllus pennsylvanicus and Nemobius fasciatus,
Comp Biochem Physiol B, 1976
Pubmed ID: 1277805

String Representations

InChiKey (Click to copy)
OLTHARGIAFTREU-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C30H62/c1-4-6-8-10-12-13-14-15-16-17-18-19-20-21-22-23-25-27-29-30(3)28-26-24-11-9-7-5-2/h30H,4-29H2,1-3H3
SMILES (Click to copy)
CCCCCCCCC(C)CCCCCCCCCCCCCCCCCCCC

Other Databases

PubChem CID
6430462

Calculated Physicochemical Properties

Heavy Atoms 30
Rings 0
Aromatic Rings 0
Rotatable Bonds 26
Van der Waals Molecular Volume 527.56
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 11.80
Molar Refractivity 140.55

Admin

Created at
-
Updated at
15th Jul 2025