Structure Database (LMSD)

Common Name
SFE 12:1(3Z)/4:1(2E)
Systematic Name
(Z)-3-Dodecenyl (E)-2-butenoate
Synonyms
  • WE(12:1(3Z)/4:1(2E))
LM ID
LMFA07010533
Formula
C16H28O2
Exact Mass
Calculate m/z
252.20893
Sum Composition
SFE 16:2
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty esters [FA07]
Short fatty esters [FA0710]

Biological Context

Z3-Dodecenyl E2-butenoate is a female sex pheromone produced by the sweet potato weevil, C. formicarius. It has been used to bait and trap male sweet potato weevils to manage population counts in agriculture fields with reduced use of insecticides.1

This information has been provided by Cayman Chemical

References

1. Reddy, G.V.P., Gadi, N., and Taianao, A.J. Efficient sex pheromone trapping: Catching the sweetpotato weevil, Cylas formicarius. J. Chem. Ecol. 38(7), 846-853 (2012).

References

Comments
Pherobase Semiochemicals

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Cylas formicarius (#197179)
Insecta (#50557)
Identification of sex pheromone produced by female sweetpotato weevil,Cylas formicarius elegantulus (Summers).,
J Chem Ecol, 1986
Pubmed ID: 24307127

String Representations

InChiKey (Click to copy)
VPVYOJQBLAZGEP-DVRGKXNHSA-N
InChi (Click to copy)
InChI=1S/C16H28O2/c1-3-5-6-7-8-9-10-11-12-13-15-18-16(17)14-4-2/h4,11-12,14H,3,5-10,13,15H2,1-2H3/b12-11-,14-4+
SMILES (Click to copy)
O=C(/C=C/C)OCC/C=C\CCCCCCCC

Other Databases

CHEBI ID
196063
PubChem CID
9813716
Cayman ID
19787

Calculated Physicochemical Properties

Heavy Atoms 18
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 295.02
Topological Polar Surface Area 26.30
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
logP 5.09
Molar Refractivity 78.01

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Created at
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Updated at
20th Jan 2025