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29838-67-3

29838-67-3 structural image
Product Name: TAXIFOLIN 3-O-RHAMNOSIDE
Formula: C21H22O11
Synonyms: Astilbin;Dihydroquercetin 3-rhamnoside;Taxifolin 3-rhamnoside
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 179 - 180 °C
Collision Cross Section 205.87 Ų [M+H]+ [CCS Type: DT, Method: stepped-field]

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H400:Hazardous to the aquatic environment, acute hazard
Precautionary Statement Codes P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 450.4 g/mol
XLogP3 0.4
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 3
Exact Mass 450.11621151 g/mol
Monoisotopic Mass 450.11621151 g/mol
Topological Polar Surface Area 186 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 676
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

Astilbin is a flavanone glycoside that is (+)-taxifolin substituted by a alpha-L-rhamnosyl moiety at position 3 via a glycosidic linkage. It has a role as a radical scavenger, an anti-inflammatory agent and a plant metabolite. It is an alpha-L-rhamnoside, a member of 3'-hydroxyflavanones, a tetrahydroxyflavanone, a flavanone glycoside, a monosaccharide derivative and a member of 4'-hydroxyflavanones. It is functionally related to a (+)-taxifolin. It is an enantiomer of a neoastilbin.