Structure Database (LMSD)

Common Name
7-Hexyltridecane
Systematic Name
7-Hexyltridecane
Synonyms
LM ID
LMFA11000708
Formula
C19H40
Exact Mass
Calculate m/z
268.313
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
Microcoleus vaginatus (#119532)
Cyanophyceae (#3028117)
[Branched alkanes and other apolar compounds produced by the cyanobacterium Microcoleus vaginatus from the Negev desert],
Bioorg Khim, 2001
Pubmed ID: 11357397

String Representations

InChiKey (Click to copy)
PLHNETQGLPOKGV-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C19H40/c1-4-7-10-13-16-19(17-14-11-8-5-2)18-15-12-9-6-3/h19H,4-18H2,1-3H3
SMILES (Click to copy)
C(C(CCCCCC)CCCCCC)CCCCC

Other Databases

PubChem CID
298667

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 337.26
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 7.51
Molar Refractivity 89.77

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Updated at
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