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23180-65-6

23180-65-6 structural image
Product Name: COLUMBIANETIN ACETATE
Formula: C16H16O5
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COMPUTED DESCRIPTORS

Molecular Weight 288.29 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 3
Exact Mass 288.09977361 g/mol
Monoisotopic Mass 288.09977361 g/mol
Topological Polar Surface Area 61.8 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 481
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

Columbianetin acetate is an acetate ester obtained by formal acetylation of the tertiary hydroxy group of 2-[(8S)-2-oxo-8,9-dihydro-2H-furo[2,3-h][1]benzopyran-8-yl]propan-2-ol. It has a role as a plant metabolite. It is a furanocoumarin and an acetate ester.