Structure Database (LMSD)

Common Name
6E-Nonen-1-ol
Systematic Name
6E-Nonen-1-ol
Synonyms
LM ID
LMFA05000133
Formula
C9H18O
Exact Mass
Calculate m/z
142.135765
Sum Composition
FOH 9:1
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
Ceratitis capitata (#7213)
Insecta (#50557)
No citation found

String Representations

InChiKey (Click to copy)
XJHRZBIBSSVCEL-ONEGZZNKSA-N
InChi (Click to copy)
InChI=1S/C9H18O/c1-2-3-4-5-6-7-8-9-10/h3-4,10H,2,5-9H2,1H3/b4-3+
SMILES (Click to copy)
OCCCCC/C=C/CC

Other Databases

HMDB ID
HMDB0059887
CHEBI ID
179598
PubChem CID
5362811

Calculated Physicochemical Properties

Heavy Atoms 10
Rings 0
Aromatic Rings 0
Rotatable Bonds 6
Van der Waals Molecular Volume 170.41
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 2.79
Molar Refractivity 45.47

Admin

Created at
-
Updated at
6th Jan 2025