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56389-87-8

56389-87-8 structural image
Product Name: Flavomarein,2R-3',4',8-Trihydroxyflavanone-7-O-glucoside
Formula: C21H22O11
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COMPUTED DESCRIPTORS

Molecular Weight 450.4 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 4
Exact Mass 450.11621151 g/mol
Monoisotopic Mass 450.11621151 g/mol
Topological Polar Surface Area 186 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 662
Isotope Atom Count 0
Defined Atom Stereocenter Count 6
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

(R)-2-(3,4-Dihydroxyphenyl)-8-hydroxy-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)chroman-4-one is a natural product found in Coreopsis with data available.