Structure Database (LMSD)

O
Common Name
6,7-Epoxy-3Z,9Z-tricosadiene
Systematic Name
6,7-Epoxy-3Z,9Z-tricosadiene
Synonyms
LM ID
LMFA12000328
Formula
C23H42O
Exact Mass
Calculate m/z
334.323565
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)
CYYDOLGVLZBCDH-UWEBADFRSA-N
InChi (Click to copy)
InChI=1S/C23H42O/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-19-21-23-22(24-23)20-18-6-4-2/h6,17-19,22-23H,3-5,7-16,20-21H2,1-2H3/b18-6-,19-17-
SMILES (Click to copy)
CC/C=C\CC1OC1C/C=C\CCCCCCCCCCCCC

References

Comments
Pherobase Semiochemicals

Other Databases

PubChem CID
56936269

Calculated Physicochemical Properties

Heavy Atoms 24
Rings 1
Aromatic Rings 0
Rotatable Bonds 17
Van der Waals Molecular Volume 397.61
Topological Polar Surface Area 12.53
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 8.33
Molar Refractivity 108.57

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Created at
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Updated at
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