Structure Database (LMSD)

Common Name
6-hydroxy-4E,8Z,11Z,14Z-eicosatetraenoic acid
Systematic Name
6-hydroxy-4E,8Z,11Z,14Z-eicosatetraenoic acid
Synonyms
  • 4,8,11,14-Eicosatetraenoic acid, 6-hydroxy-, (E,Z,Z,Z)-
LM ID
LMFA03060054
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

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)
RDQJANOYLNUONG-CVJUOOOLSA-N
InChi (Click to copy)
InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19(21)17-14-15-18-20(22)23/h6-7,9-10,12-14,17,19,21H,2-5,8,11,15-16,18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,17-14+
SMILES (Click to copy)
C(CC/C=C/C(O)C/C=C\C/C=C\C/C=C\CCCCC)(=O)O

Other Databases

LIPIDAT ID
4633
PubChem CID
5312974

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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