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752-61-4

752-61-4 structural image
Product Name: DIGITALIN
Formula: C36H56O14
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COMPUTED DESCRIPTORS

Molecular Weight 712.8 g/mol
XLogP3 -0.3
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 7
Exact Mass 712.36700646 g/mol
Monoisotopic Mass 712.36700646 g/mol
Topological Polar Surface Area 214 Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 1300
Isotope Atom Count 0
Defined Atom Stereocenter Count 19
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

Digitalin is a cardenolide glycoside. It is functionally related to a gitoxigenin.