Structure Database (LMSD)

Common Name
2-Methylhexacosane
Systematic Name
2-Methylhexacosane
Synonyms
LM ID
LMFA11000345
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)
BEBPORIYFVRVCP-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C27H56/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(2)3/h27H,4-26H2,1-3H3
SMILES (Click to copy)
CC(C)CCCCCCCCCCCCCCCCCCCCCCCC

Other Databases

HMDB ID
HMDB0032661
PubChem CID
150931
Cayman ID
9003585

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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