Structure Database (LMSD)

Common Name
9Z-Dodecen-1-ol
Systematic Name
9Z-Dodecen-1-ol
Synonyms
LM ID
LMFA05000158
Formula
C12H24O
Exact Mass
Calculate m/z
184.182715
Sum Composition
FOH 12:1
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
Barbara colfaxiana (#1666468)
Insecta (#50557)
Chemical and field studies on the sex pheromones of the cone and seed moths Barbara colfaxiana and Laspeyresia youngana,
Experientia, 1977

String Representations

InChiKey (Click to copy)
GJNNIRNIXNLOJP-ARJAWSKDSA-N
InChi (Click to copy)
InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h3-4,13H,2,5-12H2,1H3/b4-3-
SMILES (Click to copy)
OCCCCCCCC/C=C\CC

Other Databases

CHEBI ID
169611
PubChem CID
6431342

Calculated Physicochemical Properties

Heavy Atoms 13
Rings 0
Aromatic Rings 0
Rotatable Bonds 9
Van der Waals Molecular Volume 222.31
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 3.96
Molar Refractivity 59.33

Admin

Created at
-
Updated at
11th Dec 2024