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Glucoraphanin

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Glucoraphanin / CAS : 21414-41-5

Appearance Quasi-white crystalline powder, soluble in methanol, ethanol, DMSO and other organic solvents, derived from radish seed UN 0
HS 29420000 DG Class 0
Synonyms 4-Methylsulfinylbutylglucosinolate; 1-Thio-β-D-Glucopyranose 1-[N-(Hydroxysulfonyloxy)-5-(Methylsulfinyl)Pentanimidate]; 1-Thio-β-D-Glucopyranose 1-[N-(Hydroxysulfonyloxy)-5-Methylsulfinylpentanimidate]; N-(Hydroxysulfonyloxy)-5-(Methylsulfinyl)Pentanimidothioic Acid β-D-Glucopyranosyl Ester; Glucoraphanin Potassium Salt(Rg); Glucoraphanin Potassium Salt(P); Glucoraphanin Potassium Salt(Sh)
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Properties

Summary

Formula
C12H23NO10S3
Molecular Mass
437.51
Exact Mass
437.04800
PSA
236.07000
Logp
0.14770
IUPAC
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-5-methylsulfinyl-N-sulfooxypentanimidothioate
SMILES
CS(=O)CCCCC(=NOS(=O)(=O)O)S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

Attribute classification

Matter Classification
organic
Category
Plant and Other Extracts > Plant Extracts

Chemical and Physical Properties

Density
1.78±0.1 g/cm3 (20 ºC 760 Torr)
Appearance
Quasi-white crystalline powder, soluble in methanol, ethanol, DMSO and other organic solvents, derived from radish seed
Acidity and Basicity
acidness

Export information

HS Code
29420000
Export Rebate
13%
UN No.
0
DG-Class
0

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