Structure Database (LMSD)

Common Name
4E,6Z-Hexadecadien-1-ol
Systematic Name
4E,6Z-Hexadecadien-1-ol
Synonyms
LM ID
LMFA05000200
Formula
C16H30O
Exact Mass
Calculate m/z
238.229666
Sum Composition
FOH 16:2
Status
Curated
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Fatty alcohols [FA05]

Reactions

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ⓘ 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.
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Reactions graph legend

References

Comments
Pherobase

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Stathmopoda masinissa (#1511825)
Insecta (#50557)
Sex pheromone of the persimmon fruit moth, Stathmopoda masinissa: identification and laboratory bioassay of (4E, 6Z)-4,6-hexadecadien-1-ol derivatives.,
J Chem Ecol, 2003
Pubmed ID: 14682526

String Representations

InChiKey (Click to copy)
WRYCXDWXELTMPO-JPYSRSMKSA-N
InChi (Click to copy)
InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h10-13,17H,2-9,14-16H2,1H3/b11-10-,13-12+
SMILES (Click to copy)
OCCC/C=C/C=C\CCCCCCCCC

Other Databases

CHEBI ID
179676
PubChem CID
44256523

Calculated Physicochemical Properties

Heavy Atoms 17
Rings 0
Aromatic Rings 0
Rotatable Bonds 12
Van der Waals Molecular Volume 288.87
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 5.30
Molar Refractivity 77.70

Admin

Created at
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Updated at
26th Dec 2024