Structure Database (LMSD)

Common Name
8-methyl-heptadecane
Systematic Name
8-methyl-heptadecane
Synonyms
LM ID
LMFA11000600
Formula
C18H38
Exact Mass
Calculate m/z
254.297351
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Nostoc sp. (#1180)
Cyanophyceae (#3028117)
Separation and identification of hydrocarbons and other volatile compounds from cultured blue-green alga Nostoc sp. by gas chromatography-mass spectrometry using serially coupled capillary columns with consecutive nonpolar and semipolar stationary phases.,
J Chromatogr A, 1999
Pubmed ID: 10596980

String Representations

InChiKey (Click to copy)
AFKUSTCGONJZHE-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C18H38/c1-4-6-8-10-11-13-15-17-18(3)16-14-12-9-7-5-2/h18H,4-17H2,1-3H3
SMILES (Click to copy)
C(CCCCCC)C(C)CCCCCCCCC

Other Databases

PubChem CID
292723

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 319.96
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 7.12
Molar Refractivity 85.15

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Updated at
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