Structure Database (LMSD)

OH O OH
Common Name
19-HETE
Systematic Name
(5Z,8Z,11Z,14Z)-19-hydroxy-5,8,11,14-icosatetraenoic acid
Synonyms
  • (5Z,8Z,11Z,14Z)-19-hydroxy-5,8,11,14-eicosatetraenoic acid
  • (all-cis)-19-hydroxy-5,8,11,14-eicosatetraenoic acid
  • (all-cis)-19-hydroxy-5,8,11,14-icosatetraenoic acid
  • 19-hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid
  • 19-hydroxy-5Z,8Z,11Z,14Z-icosatetraenoic acid
  • 19-hydroxyarachidonic acid
LM ID
LMFA03060106
Formula
C20H32O3
Exact Mass
Calculate m/z
320.235145
Sum Composition
FA 20:4;O
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Fatty Acyls [FA]
Eicosanoids [FA03]
Hydroxy/hydroperoxyeicosatetraenoic acids [FA0306]
Fatty Acids and Conjugates [FA01]
Unsaturated fatty acids [FA0103]
Hydroxy fatty acids [FA0105]

String Representations

InChiKey (Click to copy)
XFUXZHQUWPFWPR-TWVHMNNTSA-N
InChi (Click to copy)
InChI=1S/C20H32O3/c1-19(21)17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18-20(22)23/h3-6,9-12,19,21H,2,7-8,13-18H2,1H3,(H,22,23)/b5-3-,6-4-,11-9-,12-10-
SMILES (Click to copy)
C(C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O)CC(O)C

References

Other Databases

CHEBI ID
63998
PubChem CID
20839325
SwissLipids ID
SLM:000389383

Calculated Physicochemical Properties

Heavy Atoms 23
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 367.73
Topological Polar Surface Area 57.53
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 3
logP 5.47
Molar Refractivity 97.94

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Created at
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Updated at
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