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1397-77-9

1397-77-9 structural image
Product Name: actinorhodin
Formula: C32H26O14
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COMPUTED DESCRIPTORS

Molecular Weight 634.5 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 5
Exact Mass 634.13225550 g/mol
Monoisotopic Mass 634.13225550 g/mol
Topological Polar Surface Area 242 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1520
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
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

Actinorhodin is a member of the class of benzoisochromanequinone that is produced by Streptomyces coelicolor A3(2) and exhibits antibiotic activity. It has a role as a bacterial metabolite and an antimicrobial agent. It is a benzoisochromanequinone, a polyketide, a dicarboxylic acid, a polyphenol, a ring assembly and a member of p-quinones. It is a conjugate acid of an actinorhodin(3-).