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35241-54-4

35241-54-4 structural image
Product Name: 2',6'-DIHYDROXY-4,4'-DIMETHOXYDIHYDROCHALCONE
Formula: C17H18O5
Synonyms: Calomelanen
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COMPUTED DESCRIPTORS

Molecular Weight 302.32 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 302.11542367 g/mol
Monoisotopic Mass 302.11542367 g/mol
Topological Polar Surface Area 76 Ų
Heavy Atom Count 22
Formal Charge 0
Complexity 339
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
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

1-(2,6-Dihydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)propan-1-one is a natural product found in Pityrogramma calomelanos, Pityrogramma ebenea, and other organisms with data available.