Structure Database (LMSD)

Common Name
1-Pentacosene
Systematic Name
1-Pentacosene
Synonyms
LM ID
LMFA11000326
Formula
C25H50
Exact Mass
Calculate m/z
350.39125
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)
BDWBGSCECOPTTH-UHFFFAOYSA-N
InChi (Click to copy)
InChI=1S/C25H50/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-25H2,2H3
SMILES (Click to copy)
C=CCCCCCCCCCCCCCCCCCCCCCCC

Other Databases

CHEBI ID
78465
PubChem CID
528972

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 22
Van der Waals Molecular Volume 438.42
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 9.77
Molar Refractivity 117.45

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Created at
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Updated at
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