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529-49-7

529-49-7 structural image
Product Name: GENTISEIN
Formula: C13H8O5
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 321 - 323 °C

COMPUTED DESCRIPTORS

Molecular Weight 244.20 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 244.03717335 g/mol
Monoisotopic Mass 244.03717335 g/mol
Topological Polar Surface Area 87 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 344
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

Gentisein is a member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3 and 7. It has a role as a plant metabolite. It is a member of xanthones and a polyphenol.