Structure Database (LMSD)

Common Name
11Z,13Z-Octadecadienal
Systematic Name
11Z,13Z-Octadecadienal
Synonyms
LM ID
LMFA06000239
Formula
C18H32O
Exact Mass
Calculate m/z
264.245316
Sum Composition
FAL 18:2
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

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
Manduca sexta (#7130)
Insecta (#50557)
Identification of a pheromone blend attractive to Manduca sexta (L.) males in a wind tunnel.,
Arch Insect Biochem Physiol, 1989

String Representations

InChiKey (Click to copy)
YMRRHPHPVJAAPR-ISTTXYCBSA-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/h5-8,18H,2-4,9-17H2,1H3/b6-5-,8-7-
SMILES (Click to copy)
C(CCCCCCCCC/C=C\C=C/CCCC)(=O)[H]

Other Databases

PubChem CID
14423139

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
-
Updated at
5th Dec 2024