Structure Database (LMSD)
Common Name
(3Z,6E)-14-methyl-alpha-farnesene
Systematic Name
3,11-dimethyl-7-ethyl-dodeca-1,3Z,6E,10-tetraene
Synonyms
3D model of (3Z,6E)-14-methyl-alpha-farnesene
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
Taxonomy Information
Curated from
NCBI taxonomy class
Reference
Ooceraea biroi
(#2015173)
Insecta
(#50557)
Identification and Stereoselective Total Synthesis of an Insect Homosesquiterpene from the Clonal Raider Ant <i>Ooceraea biroi</i>.,
J Nat Prod, 2025
J Nat Prod, 2025
Pubmed ID:
40865005
String Representations
InChiKey (Click to copy)
LPHPRLLVGKQFEL-GYPBQELOSA-N
InChi (Click to copy)
InChI=1S/C16H26/c1-6-15(5)11-9-13-16(7-2)12-8-10-14(3)4/h6,10-11,13H,1,7-9,12H2,2-5H3/b15-11-,16-13+
SMILES (Click to copy)
C/C(/C)=C/CC/C(/CC)=C/C/C=C(/C)\C=C
Calculated Physicochemical Properties
Heavy Atoms
16
Rings
Aromatic Rings
Rotatable Bonds
7
Van der Waals Molecular Volume
274.80
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
Hydrogen Bond Acceptors
logP
5.59
Molar Refractivity
75.61
Admin
Created at
10th Sep 2025
Updated at
10th Sep 2025