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6619-95-0

6619-95-0 structural image
Product Name: Deacetylxylopic acid
Formula: C20H30O3
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COMPUTED DESCRIPTORS

Molecular Weight 318.4 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 318.21949481 g/mol
Monoisotopic Mass 318.21949481 g/mol
Topological Polar Surface Area 57.5 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 569
Isotope Atom Count 0
Defined Atom Stereocenter Count 7
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

Deacetylxylopic acid is a natural product found in Rhadinothamnus rudis and Tithonia longiradiata with data available.