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85233-29-0

85233-29-0 structural image
Product Name: 3,7-dihydroxytropolone
Formula: C7H6O4
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COMPUTED DESCRIPTORS

Molecular Weight 154.12 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 154.02660867 g/mol
Monoisotopic Mass 154.02660867 g/mol
Topological Polar Surface Area 77.8 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 283
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

3,7-dihydroxytropolone is a cyclic ketone that is tropolone in which the hydrogens at positions 3 and 7 are substituted by hydroxy groups. It is isolated from the soil bacterium Streptomyces tropolofaciens strain K611-97. It has a role as an antineoplastic agent and a bacterial metabolite. It is a cyclic ketone, a triol, an alpha-hydroxy ketone and an enol. It is functionally related to a tropolone.