Structure Database (LMSD)

Common Name
13Z-Nonacosene
Systematic Name
13Z-Nonacosene
Synonyms
LM ID
LMFA11000077
Formula
C29H58
Exact Mass
Calculate m/z
406.45385
Status
Curated
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)
BXDVXJGLEVABDI-RFBIWTDZSA-N
InChi (Click to copy)
InChI=1S/C29H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h25,27H,3-24,26,28-29H2,1-2H3/b27-25-
SMILES (Click to copy)
CCCCCCCCCCCC/C=C\CCCCCCCCCCCCCCC

Other Databases

PubChem CID
13456538

Calculated Physicochemical Properties

Heavy Atoms 29
Rings 0
Aromatic Rings 0
Rotatable Bonds 25
Van der Waals Molecular Volume 507.62
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 11.33
Molar Refractivity 135.91

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Created at
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Updated at
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