Structure Database (LMSD)

Common Name
11E-Tetradecenal
Systematic Name
11E-Tetradecenal
Synonyms
LM ID
LMFA06000172
Formula
C14H26O
Exact Mass
Calculate m/z
210.198365
Sum Composition
FAL 14:1
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

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

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Sparganothis pettitana (#687138)
Insecta (#50557)
Sex Pheromone of the Maple Leaf Roller Cenopsis Acerivorana (Lepidoptera: Tortricidae),
The Canadian Entomologist, 1983

String Representations

InChiKey (Click to copy)
SPFYVVCZIOLVOK-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-4,14H,2,5-13H2,1H3/b4-3+
SMILES (Click to copy)
C(CCCCCCCCC/C=C/CC)(=O)[H]

Other Databases

CHEBI ID
168731
PubChem CID
6365677

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 254.27
Topological Polar Surface Area 17.07
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 1
logP 4.66
Molar Refractivity 67.05

Admin

Created at
-
Updated at
23rd Jan 2025