Abacavir 5'-Glucuronide
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Abacavir 5'-Glucuronide
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CAS No:
384329-76-4
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Formula:
C20H26N6O7
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Chemical Name:
Abacavir 5'-Glucuronide
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Synonyms:
[(1S,4R)-4-[2-amino-6-(cyclopropylamino)-9H-purin-9-yl]-2-cyclopenten-1-yl]methyl-D-Glucopyranosiduronic Acid;Abacavir 5’--D-Glucuronide;Abacavir 5'-Glucuronide;Abacavir 5'-b-D-glucuronide
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CAS No:
Description
White to Off-White Solid
Abacavir 5'-glucuronide is a glucosiduronic acid derivative formed by linkage of beta-D-glucosiduronic acid with the 5'-oxygen of abacavir. One of the two major metabolites of abacavir in humans (the other is the 5'-carboxylic acid, CHEBI:64192). It has a role as a metabolite. It derives from an abacavir.
Computed Properties
Molecular Weight:462.5
XLogP3:-0.5
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:462.18629719
Monoisotopic Mass:462.18629719
Topological Polar Surface Area:198
Heavy Atom Count:33
Complexity:756
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Abacavir Related CoMpound D
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188062-50-2
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ABACAVIR SULFATE
136777-48-5
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Abacavir Carboxylate Formula
384380-52-3
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Abacavir Formula
136470-78-5
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Abacavir 5’-Phosphate Formula
136470-77-4