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6681-13-6

6681-13-6 structural image
Product Name: HERNANDEZINE
Formula: C39H44N2O7
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COMPUTED DESCRIPTORS

Molecular Weight 652.8 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 5
Exact Mass 652.31485175 g/mol
Monoisotopic Mass 652.31485175 g/mol
Topological Polar Surface Area 71.1 Ų
Heavy Atom Count 48
Formal Charge 0
Complexity 1030
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

Hernandezine is a member of isoquinolines and a bisbenzylisoquinoline alkaloid.