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4331-22-0

4331-22-0 structural image
Product Name: VERSICOLORINB
Formula: C18H12O7
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COMPUTED DESCRIPTORS

Molecular Weight 340.3 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 0
Exact Mass 340.05830272 g/mol
Monoisotopic Mass 340.05830272 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 606
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

Versicolorin B is an organic heteropentacyclic compound that is 2,3,3a,12a-tetrahydroanthra[2,3-b]furo[3,2-d]furan-5,10-dione carrying three hydroxy substituents at positions 4, 6 and 8. It has a role as an Aspergillus metabolite. It is an organic heteropentacyclic compound, a cyclic acetal, a polyphenol and a member of p-quinones. It is a conjugate acid of a versicolorin B(1-).