Structure Database (LMSD)
Common Name
SFE 18:1(7Z)/4:0
Systematic Name
(Z)-7-Octadecenyl butyrate
Synonyms
- WE(18:1(7Z)/4:0)
3D model of SFE 18:1(7Z)/4:0
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
References
Comments
Pherobase Semiochemicals
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Euproctis similis
(#987935)
Insecta
(#50557)
Identification of the Sex Attractant Pheromone of the Browntail Moth, Euproctis similis (FUESSLY) (Lepidoptera: Lymantriidae),
Appl Entomol Zool, 1994
Appl Entomol Zool, 1994
DOI:
10.1303/aez.29.21
String Representations
InChiKey (Click to copy)
TWRNSCHKHQNZPX-YPKPFQOOSA-N
InChi (Click to copy)
InChI=1S/C22H42O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-24-22(23)20-4-2/h13-14H,3-12,15-21H2,1-2H3/b14-13-
SMILES (Click to copy)
O=C(CCC)OCCCCCC/C=C\CCCCCCCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
24
Rings
0
Aromatic Rings
0
Rotatable Bonds
19
Van der Waals Molecular Volume
401.46
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
7.65
Molar Refractivity
105.81
Admin
Created at
-
Updated at
28th Feb 2025