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970-73-0

970-73-0 structural image
Product Name: (+)-GALLOCATECHIN
Formula: C15H14O7
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 189 - 191 °C

COMPUTED DESCRIPTORS

Molecular Weight 306.27 g/mol
XLogP3 0
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 1
Exact Mass 306.07395278 g/mol
Monoisotopic Mass 306.07395278 g/mol
Topological Polar Surface Area 131 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 380
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

Gallocatechin is a catechin that is a flavan substituted by hydroxy groups at positions 3, 3', 4', 5, 5' and 7 (the trans isomer). It is isolated from Acacia mearnsii. It has a role as a metabolite. It is a catechin and a flavan-3,3',4',5,5',7-hexol.