Structure Database (LMSD)

Common Name
7Z,10Z-Hexadecadienal
Systematic Name
7Z,10Z-Hexadecadienal
Synonyms
LM ID
LMFA06000279
Formula
C16H28O
Exact Mass
Calculate m/z
236.214015
Sum Composition
FAL 16:2
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
Chilecomadia valdiviana (#1178237)
Insecta (#50557)
Identification of a Novel Moth Sex Pheromone Component from Chilecomadia valdiviana.,
J Chem Ecol, 2016
Pubmed ID: 27631524

String Representations

InChiKey (Click to copy)
WIWVOAOSGQCJSL-HZJYTTRNSA-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/h6-7,9-10,16H,2-5,8,11-15H2,1H3/b7-6-,10-9-
SMILES (Click to copy)
C(=O)CCCCC/C=C\C/C=C\CCCCC

Other Databases

PubChem CID
5365665

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 286.23
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 5.22
Molar Refractivity 76.19

Admin

Created at
15th Apr 2021
Updated at
15th Apr 2021