Structure Database (LMSD)
Common Name
SFE 8:1(2E)/2:0
Systematic Name
2E-Octenyl acetate
Synonyms
- SFE(8:1(2E)/2:0)
No other lipid differing only in stereochemistry/bond geometry found
3D model of SFE 8:1(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)
MBRLTLPMVMFRTJ-BQYQJAHWSA-N
InChi (Click to copy)
InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-12-10(2)11/h7-8H,3-6,9H2,1-2H3/b8-7+
SMILES (Click to copy)
O(C(=O)C)C/C=C/CCCCC
References
Comments
Pherobase
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Geocoris punctipes
(#1468586)
Insecta
(#50557)
Female-produced sex pheromone of the predatory bug Geocoris punctipes,
J Chem Ecol, 2000
J Chem Ecol, 2000
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
12
Rings
0
Aromatic Rings
0
Rotatable Bonds
7
Van der Waals Molecular Volume
193.86
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
2.97
Molar Refractivity
50.41
Admin
Created at
-
Updated at
31st Jul 2023