Structure Database (LMSD)
Common Name
SFE 11:1(2E)/2:0
Systematic Name
2-Undecenyl acetate
Synonyms
- SFE(11:1(2E)/2:0)
3D model of SFE 11:1(2E)/2:0
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Main
Classification
String Representations
InChiKey (Click to copy)
WITKTXDMHHYCJB-ZHACJKMWSA-N
InChi (Click to copy)
InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-15-13(2)14/h10-11H,3-9,12H2,1-2H3/b11-10+
SMILES (Click to copy)
O(C(=O)C)C/C=C/CCCCCCCC
References
Comments
Pherobase
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Polistes dominula
(#743375)
Insecta
(#50557)
Volatiles from the venom of five species of paper wasps (Polistes dominulus, P. gallicus, P. nimphus, P. sulcifer and P. olivaceus).,
Toxicon, 2006
Toxicon, 2006
Pubmed ID:
16698055
Other Databases
PubChem CID
Calculated Physicochemical Properties
Heavy Atoms
15
Rings
0
Aromatic Rings
0
Rotatable Bonds
10
Van der Waals Molecular Volume
245.76
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
4.14
Molar Refractivity
64.26
Admin
Created at
-
Updated at
7th Jul 2023