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96400-45-2

96400-45-2 structural image
Product Name: luteolin 7-diglucuronide
Formula: C27H26O18
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COMPUTED DESCRIPTORS

Molecular Weight 638.5 g/mol
XLogP3 -0.6
Hydrogen Bond Donor Count 10
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 7
Exact Mass 638.11191398 g/mol
Monoisotopic Mass 638.11191398 g/mol
Topological Polar Surface Area 300 Ų
Heavy Atom Count 45
Formal Charge 0
Complexity 1150
Isotope Atom Count 0
Defined Atom Stereocenter Count 10
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

Luteolin-7-O-[beta-D-glucuronosyl-(1->2)-beta-D-glucuronide] is the glycosyloxyflavone resulting from the condensation of the hydroxy group at position 7 of luteolin with the 1 position of 2-O-beta-D-glucopyranuronosyl-beta-D-glucopyranosiduronic acid. It is a trihydroxyflavone, a glycosyloxyflavone, a dicarboxylic acid, a disaccharide derivative and a luteolin O-glucuronoside. It is a conjugate acid of a luteolin 7-O-[(beta-D-glucosiduronate)-(1->2)-(beta-D-glucosiduronate)].