Structure Database (LMSD)

Common Name
9Z-Pentacosene
Systematic Name
9Z-Pentacosene
Synonyms
LM ID
LMFA11000114
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)
YJTCMKZGFBOKQS-ZPHPHTNESA-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/h17,19H,3-16,18,20-25H2,1-2H3/b19-17-
SMILES (Click to copy)
CCCCCCCC/C=C\CCCCCCCCCCCCCCC

Other Databases

PubChem CID
14159395
Cayman ID
9002807

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 21
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

Admin

Created at
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Updated at
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