Structure Database (LMSD)

Common Name
6E-octadecenal
Systematic Name
6E-octadecenal
Synonyms
LM ID
LMFA06000283
Status
Active
Exact Mass
Calculate m/z
266.260965
Formula
Abbrev


Download as...
MDLMOL SDF CSV TSV
MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Main

Classification

String Representations

InChiKey (Click to copy)
CMVCTUZMEJVSMW-OUKQBFOZSA-N
InChi (Click to copy)
InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h12-13,18H,2-11,14-17H2,1H3/b13-12+
SMILES (Click to copy)
C(CCCC/C=C/CCCCCCCCCCC)(=O)[H]

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

Other Databases

PubChem CID

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 15
Van der Waals Molecular Volume 323.47
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 6.22
Molar Refractivity 85.52

Admin

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