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113378-31-7

113378-31-7 structural image
Product Name: Semduramicin
Formula: C45H76O16
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COMPUTED DESCRIPTORS

Molecular Weight 873.1 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 11
Exact Mass 872.51333633 g/mol
Monoisotopic Mass 872.51333633 g/mol
Topological Polar Surface Area 211 Ų
Heavy Atom Count 61
Formal Charge 0
Complexity 1540
Isotope Atom Count 0
Defined Atom Stereocenter Count 23
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

See also: Semduramicin Sodium (is active moiety of).