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42719-32-4

42719-32-4 structural image
Product Name: pedunculoside
Formula: C36H58O10
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COMPUTED DESCRIPTORS

Molecular Weight 650.8 g/mol
XLogP3 3.5
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 5
Exact Mass 650.40299804 g/mol
Monoisotopic Mass 650.40299804 g/mol
Topological Polar Surface Area 177 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1240
Isotope Atom Count 0
Defined Atom Stereocenter Count 16
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

Pedunculoside is a natural product found in Ilex chinensis, Ilex excelsa, and other organisms with data available.