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21705-02-2

21705-02-2 structural image
Product Name: EPSILON-AMANITIN
Formula: C39H53N9O14S
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COMPUTED DESCRIPTORS

Molecular Weight 904.0 g/mol
XLogP3 -2.7
Hydrogen Bond Donor Count 12
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 6
Exact Mass 903.34326857 g/mol
Monoisotopic Mass 903.34326857 g/mol
Topological Polar Surface Area 374 Ų
Heavy Atom Count 63
Formal Charge 0
Complexity 1820
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 11
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

epsilon-Amanitin is a natural product found in Acanthochlamys bracteata with data available.