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41682-44-4

41682-44-4 structural image
Product Name: 8H-1,3-Dioxolo[4,5-g][1]benzopyran-8-one, 9-hydroxy-7-(3,4,5-trimethoxyphenyl)-
Formula: C19H16O8
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COMPUTED DESCRIPTORS

Molecular Weight 372.3 g/mol
XLogP3 3.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 372.08451746 g/mol
Monoisotopic Mass 372.08451746 g/mol
Topological Polar Surface Area 92.7 Ų
Heavy Atom Count 27
Formal Charge 0
Complexity 578
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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

9-Hydroxy-7-(3,4,5-trimethoxyphenyl)-8H-1,3-dioxolo[4,5-g][1]benzopyran-8-one is a natural product found in Iris domestica with data available.