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103106-23-6

103106-23-6 structural image
Product Name: napyradiomycin B1
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COMPUTED DESCRIPTORS

Molecular Weight 515.8 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 514.108057 g/mol
Monoisotopic Mass 514.108057 g/mol
Topological Polar Surface Area 83.8 Ų
Heavy Atom Count 33
Formal Charge 0
Complexity 872
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 5
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

3,4a-Dichloro-10a-[(3-chloro-2,2-dimethyl-6-methylidenecyclohexyl)methyl]-6,8-dihydroxy-2,2-dimethyl-3,4-dihydrobenzo[g]chromene-5,10-dione is a natural product found in Streptomyces aculeolatus with data available.