Structure Database (LMSD)

Common Name
11E-Tetradecen-1-ol
Systematic Name
11E-Tetradecen-1-ol
Synonyms
LM ID
LMFA05000173
Formula
C14H28O
Exact Mass
Calculate m/z
212.214015
Sum Composition
FOH 14:1
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
Citrus unshiu (#55188)
Magnoliopsida (#3398)
Characterization of Citrus unshiu (C. unshiu Marcov. forma Miyagawa-wase) blossom aroma by solid-phase microextraction in conjunction with an electronic nose.,
J Agric Food Chem, 2003
Pubmed ID: 12517105

String Representations

InChiKey (Click to copy)
YGHAIPJLMYTNAI-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h3-4,15H,2,5-14H2,1H3/b4-3+
SMILES (Click to copy)
OCCCCCCCCCC/C=C/CC

Other Databases

CHEBI ID
186758
PubChem CID
1712011

Calculated Physicochemical Properties

Heavy Atoms 15
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 256.91
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 4.74
Molar Refractivity 68.56

Admin

Created at
-
Updated at
23rd Dec 2024