Structure Database (LMSD)

O
Common Name
cis-9,10-Epoxytricosane
Systematic Name
cis-9,10-Epoxytricosane
Synonyms
LM ID
LMFA12000329
Formula
C23H46O
Exact Mass
Calculate m/z
338.354865
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Oxygenated hydrocarbons [FA12]

String Representations

InChiKey (Click to copy)
ABEVMMJCCLROBC-XZOQPEGZSA-N
InChi (Click to copy)
InChI=1S/C23H46O/c1-3-5-7-9-11-12-13-14-15-17-19-21-23-22(24-23)20-18-16-10-8-6-4-2/h22-23H,3-21H2,1-2H3/t22-,23+/m0/s1
SMILES (Click to copy)
CCCCCCCC[C@@H]1O[C@@H]1CCCCCCCCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

PubChem CID
14057697

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 1
Aromatic Rings 0
Rotatable Bonds 19
Van der Waals Molecular Volume 402.89
Topological Polar Surface Area 12.53
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 8.78
Molar Refractivity 108.76

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Created at
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Updated at
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