Structure Database (LMSD)
Common Name
Farnesyl acetate
Systematic Name
3,7,11-Trimethyl-2,6,10-dodecatrienyl acetate
Synonyms
3D model of Farnesyl acetate
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
Level 4 Class
References
Comments
Pherobase
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Erethizon dorsatum
(#34844)
Mammalia
(#40674)
Warning Odor of the North American Porcupine (Erethizon dorsatum),
J Chem Ecol, 1997
J Chem Ecol, 1997
Synaptus filiformis
(#1588603)
Insecta
(#50557)
Identification of female-produced sex pheromones and their geographical differences in pheromone gland extract composition from click beetles (Col., Elateridae),
J Appl Entomol, 1996
J Appl Entomol, 1996
String Representations
InChiKey (Click to copy)
ZGIGZINMAOQWLX-NCZFFCEISA-N
InChi (Click to copy)
InChI=1S/C17H28O2/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-19-17(5)18/h8,10,12H,6-7,9,11,13H2,1-5H3/b15-10+,16-12+
SMILES (Click to copy)
O(C(=O)C)C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
19
Rings
0
Aromatic Rings
0
Rotatable Bonds
9
Van der Waals Molecular Volume
309.68
Topological Polar Surface Area
26.30
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
logP
5.25
Molar Refractivity
82.54
Admin
Created at
-
Updated at
13th Dec 2024