Structure Database (LMSD)

Common Name
9Z-Tetradecenal
Systematic Name
9Z-Tetradecenal
Synonyms
LM ID
LMFA06000181
Formula
C14H26O
Exact Mass
Calculate m/z
210.198365
Sum Composition
FAL 14:1
Status
Curated
Show lipids differing only in stereochemistry/bond geometry
View NP-MRD ID(NMR) spectrum

Classification

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

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Heliothis virescens (#7102)
Insecta (#50557)
Two sex pheromone components of the tobacco budworm moth, Heliothis virescens.,
Life Sci, 1974
Pubmed ID: 4829545
Mastophora cornigera (#2508587)
Arachnida (#6854)
Chemical mimicry: bolas spiders emit components of moth prey species sex pheromones.,
Science, 1987
Pubmed ID: 17812752

String Representations

InChiKey (Click to copy)
ANJAOCICJSRZSR-WAYWQWQTSA-N
InChi (Click to copy)
InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h5-6,14H,2-4,7-13H2,1H3/b6-5-
SMILES (Click to copy)
C(CCCCCCC/C=C\CCCC)(=O)[H]

Other Databases

CHEBI ID
179485
PubChem CID
5364471

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

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Created at
-
Updated at
6th Jan 2025