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7242-07-1

7242-07-1 structural image
Product Name: 16-ACETYLGITOXIN
Formula: C43H66O15
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COMPUTED DESCRIPTORS

Molecular Weight 823.0 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 9
Exact Mass 822.44017139 g/mol
Monoisotopic Mass 822.44017139 g/mol
Topological Polar Surface Area 209 Ų
Heavy Atom Count 58
Formal Charge 0
Complexity 1560
Isotope Atom Count 0
Defined Atom Stereocenter Count 21
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

16-O-acetylgitoxin is a cardenolide glycoside that is the 16-acetate of gitoxin. It is a cardenolide glycoside and an acetate ester. It is functionally related to a gitoxin.