Structure Database (LMSD)

Common Name
13-Methylhexacosane
Systematic Name
13-Methylhexacosane
Synonyms
LM ID
LMFA11000263
Formula
C27H56
Exact Mass
Calculate m/z
380.4382
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Comments
Pherobase Semiochemicals

String Representations

InChiKey (Click to copy)
NSLXOXFTFWLFLY-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C27H56/c1-4-6-8-10-12-14-16-18-20-22-24-26-27(3)25-23-21-19-17-15-13-11-9-7-5-2/h27H,4-26H2,1-3H3
SMILES (Click to copy)
CCCCCCCCCCCCC(C)CCCCCCCCCCCCC

Other Databases

PubChem CID
6428619

Calculated Physicochemical Properties

Heavy Atoms 27
Rings 0
Aromatic Rings 0
Rotatable Bonds 23
Van der Waals Molecular Volume 475.66
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 10.63
Molar Refractivity 126.70

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Created at
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Updated at
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