Structure Database (LMSD)

Common Name
4E,6Z,10Z-Hexadecatrien-1-ol
Systematic Name
4E,6Z,10Z-Hexadecatrien-1-ol
Synonyms
LM ID
LMFA05000201
Formula
C16H28O
Exact Mass
Calculate m/z
236.214015
Sum Composition
FOH 16:3
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

Reactions

Filter by species:
ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
Click on an edge to display the reaction(s).
Reactions graph legend

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Conopomorpha cramerella (#538958)
Insecta (#50557)
Components of female sex pheromone of cocoa pod borer moth,Conopomorpha cramerella.,
J Chem Ecol, 1986
Pubmed ID: 24306393

String Representations

InChiKey (Click to copy)
AHUWGXXXQILFPZ-BFMSGXKYSA-N
InChi (Click to copy)
InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h6-7,10-13,17H,2-5,8-9,14-16H2,1H3/b7-6-,11-10-,13-12+
SMILES (Click to copy)
OCCC/C=C/C=C\CC/C=C\CCCCC

Other Databases

CHEBI ID
196155
PubChem CID
11241853

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 286.23
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.07
Molar Refractivity 77.61

Admin

Created at
-
Updated at
13th Jan 2025