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75829-43-5

75829-43-5 structural image
Product Name: Pinocembrin 7-O-beta-D-glucoside
Formula: C21H22O9
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COMPUTED DESCRIPTORS

Molecular Weight 418.4 g/mol
XLogP3 0.9
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 418.12638228 g/mol
Monoisotopic Mass 418.12638228 g/mol
Topological Polar Surface Area 146 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 595
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 6
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

5-Hydroxy-2-phenyl-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one is a natural product found in Viscum coloratum with data available.