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16234-96-1

16234-96-1 structural image
Product Name: aklavinone
Formula: C22H20O8
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COMPUTED DESCRIPTORS

Molecular Weight 412.4 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 412.11581759 g/mol
Monoisotopic Mass 412.11581759 g/mol
Topological Polar Surface Area 141 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 737
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
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

Aklavinone is an anthracycline, a member of tetracenequinones, a methyl ester and a tertiary alcohol. It has a role as an antineoplastic agent.