Structure Database (LMSD)

OH
Common Name
(9Z,12Z)-octadecadien-1-ol
Systematic Name
(9Z,12Z)-octadeca-9,12-dien-1-ol
Synonyms
  • (Z,Z)-octadeca-9,12-dien-1-ol
  • 9-cis,12-cis-octadecadien-1-ol
  • cis,cis-9,12-octadecadien-1-ol
  • cis,cis-octadeca-9,12-dien-1-ol
  • linoleyl alcohol
LM ID
LMFA05000557
Formula
C18H34O
Exact Mass
Calculate m/z
266.260965
Sum Composition
FOH 18:2
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

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

String Representations

InChiKey (Click to copy)
JXNPEDYJTDQORS-HZJYTTRNSA-N
InChi (Click to copy)
InChI=1S/C18H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h6-7,9-10,19H,2-5,8,11-18H2,1H3/b7-6-,10-9-
SMILES (Click to copy)
C(CCCCCCO)C/C=C\C/C=C\CCCCC

References

Other Databases

CHEBI ID
73534
PubChem CID
5365682
SwissLipids ID
SLM:000000212
Cayman ID
16556

Calculated Physicochemical Properties

Heavy Atoms 19
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 323.47
Topological Polar Surface Area 20.23
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 1
logP 6.08
Molar Refractivity 86.93

Reactions

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Reactions graph legend

Admin

Created at
-
Updated at
25th Apr 2022