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125276-60-0

125276-60-0 structural image
Product Name: Atemisinic Aldehyde Impurity
Formula: C15H22O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1675

COMPUTED DESCRIPTORS

Molecular Weight 218.33 g/mol
XLogP3 3.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 218.167065321 g/mol
Monoisotopic Mass 218.167065321 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 326
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
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

Artemisinic aldehyde is a sesquiterpenoid aldehyde, an intermedediate in the biosynthesis of artemisinin from artemisinic alcohol in Artemisia annua. It is a sesquiterpenoid, a carbobicyclic compound, an aldehyde and a member of octahydronaphthalenes.