Structure Database (LMSD)

Common Name
6E,11Z-octadecadienal
Systematic Name
6E,11Z-octadecadienal
Synonyms
LM ID
LMFA06000282
Formula
C18H32O
Exact Mass
Calculate m/z
264.245315
Sum Composition
FAL 18:2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty aldehydes [FA06]

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Actias luna (#63976)
Insecta (#50557)
Sex Attractant Pheromone of the Luna Moth, Actias luna (Linnaeus).,
J Chem Ecol, 2016
Pubmed ID: 27544534

String Representations

InChiKey (Click to copy)
AMVROEXDYFQCMJ-LQZWXTFHSA-N
InChi (Click to copy)
InChI=1S/C18H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h7-8,12-13,18H,2-6,9-11,14-17H2,1H3/b8-7-,13-12+
SMILES (Click to copy)
C(CCCC/C=C/CCC/C=C\CCCCCC)(=O)[H]

Other Databases

PubChem CID
129866842

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 320.83
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 6.00
Molar Refractivity 85.42

Admin

Created at
24th May 2021
Updated at
24th May 2021