(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid
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(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid
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CAS No:
115609-68-2
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Formula:
C20H30O5
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Chemical Name:
(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid
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Synonyms:
6,8,10,14-Eicosatetraenoic acid,5,12-dihydroxy-20-oxo-,(5S,6Z,8E,10E,12R,14Z)-;6,8,10,14-Eicosatetraenoic acid,5,12-dihydroxy-20-oxo-,[S-[R*,S*-(E,Z,E,Z)]]-;(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid;20-Oxoleukotriene B4;20-Oxo-LTB4
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CAS No:
Description
ChEBI: A leukotriene that is leukotriene B4 bearing an additional oxo substituent at position 20.
Solid
20-oxoleukotriene B4 is a leukotriene that is leukotriene B4 bearing an additional oxo substituent at position 20. It has a role as a metabolite. It is a leukotriene, a dihydroxy monocarboxylic acid, a hydroxyaldehyde, a polyunsaturated fatty acid, a long-chain fatty acid and an omega-oxo fatty acid. It derives from an icosa-6,8,10,14-tetraenoic acid. It is a conjugate acid of a 20-oxoleukotriene B4(1-).
(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid Basic Attributes
350.4
350.45
(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid Use and Manufacturing
Fatty Acyls [FA] -> Eicosanoids [FA03] -> Leukotrienes [FA0302]
Computed Properties
Molecular Weight:350.4
XLogP3:2.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:15
Exact Mass:350.20932405
Monoisotopic Mass:350.20932405
Topological Polar Surface Area:94.8
Heavy Atom Count:25
Complexity:463
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(5S,6Z,8E,10E,12R,14Z)-5,12-Dihydroxy-20-oxo-6,8,10,14-eicosatetraenoic acid
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