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80445-66-5

80445-66-5 structural image
Product Name: LEUKOTRIENE B5
Formula: C20H30O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
LogP 2.895

COMPUTED DESCRIPTORS

Molecular Weight 334.4 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 13
Exact Mass 334.21440943 g/mol
Monoisotopic Mass 334.21440943 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 458
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 5
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Leukotriene B5 is a leukotriene composed of (6Z,8E,10E,14Z,17Z)-icosapentaenoic acid carrying (5S)- and (12R)-hydroxy substituents. It has a role as a human xenobiotic metabolite, an anti-inflammatory agent and a rat metabolite. It is a dihydroxy monocarboxylic acid, a leukotriene, a long-chain fatty acid and a hydroxy polyunsaturated fatty acid. It is a conjugate acid of a leukotriene B5(1-).