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22688-78-4

22688-78-4 structural image
Product Name: KAEMPFEROL-3-GLUCURONIDE
Formula: C21H18O12
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COMPUTED DESCRIPTORS

Molecular Weight 462.4 g/mol
XLogP3 1
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 12
Rotatable Bond Count 4
Exact Mass 462.07982601 g/mol
Monoisotopic Mass 462.07982601 g/mol
Topological Polar Surface Area 203 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 790
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Kaempferol 3-O-glucuronide is a kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 3-position. It has a role as a metabolite. It is a kaempferol O-glucuronide and a trihydroxyflavone.