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67979-25-3

67979-25-3 structural image
Product Name: AURANTIO-OBTUSIN
Formula: C17H14O7
Synonyms: 1,3,7-Trihydroxy-2,8-dimethoxy-6-methyl-9,10-anthracenedione
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral

COMPUTED DESCRIPTORS

Molecular Weight 330.29 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 2
Exact Mass 330.07395278 g/mol
Monoisotopic Mass 330.07395278 g/mol
Topological Polar Surface Area 113 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 521
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

Aurantio-obtusin is a trihydroxyanthraquinone that is 1,3,7-trihydroxy-9,10-anthraquinone which is by methoxy groups at positions 2 and 8, and by a methyl group at position 6.