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64431-69-2

64431-69-2 structural image
Product Name: aclacinomycin S
Formula: C36H45NO13
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COMPUTED DESCRIPTORS

Molecular Weight 699.7 g/mol
XLogP3 2.9
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 8
Exact Mass 699.28909049 g/mol
Monoisotopic Mass 699.28909049 g/mol
Topological Polar Surface Area 202 Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 1270
Isotope Atom Count 0
Defined Atom Stereocenter Count 11
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

Aclacinomycin S is an anthracycline antibiotic that is produced by Streptomyces galilaeus and also exhibits antineoplastic activity. It has a role as an antimicrobial agent, an antineoplastic agent and a bacterial metabolite. It is an aminoglycoside, an anthracycline, a member of phenols, a polyketide, a disaccharide derivative, a member of tetracenequinones and a methyl ester. It is functionally related to an aklavinone. It is a tautomer of an aclacinomycin S zwitterion.