PADB-glucuronide
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PADB-glucuronide
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CAS No:
34220-56-9
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Formula:
C15H17NO9
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Chemical Name:
PADB-glucuronide
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Synonyms:
1-[4-(Acetylamino)benzoate]-beta-D-glucopyranuronic acid, 1-(p-Acetamidobenzoate)-beta-D-glucopyranuronic acid, PADB-beta-D-glucuronide;Acedoben-acyl-beta-D-glucuronide min. 98%;Acedoben-acyl-b-D-glucuronide;1-(p-AcetaMidobenzoate) β-D-Glucopyranuronic Acid;1-[4-(AcetylaMino)benzoate] β-D-Glucopyranuronic Acid;4-(AcetylaMino)benzoyl Glucuronide;Acedoben Acyl-β-D-glucuronide;PADB-glucuronide
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CAS No:
PADB-glucuronide Use and Manufacturing
Acedoben Acyl-β-D-glucuronide is a metabolite of Acedoben (A130500).
Computed Properties
Molecular Weight:355.30
XLogP3:-0.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:5
Exact Mass:355.09033112
Monoisotopic Mass:355.09033112
Topological Polar Surface Area:163
Heavy Atom Count:25
Complexity:517
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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