DESULFOGLUCORAPHANIN
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DESULFOGLUCORAPHANIN
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CAS No:
287966-62-5
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Formula:
C12H23NO7S2
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Chemical Name:
DESULFOGLUCORAPHANIN
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Synonyms:
DESULFOGLUCORAPHANIN;1-Thio-1-[N-hydroxy-5-(Methylsulfinyl)pentaniMidate] β-D-Glucopyranose;4-Methylsulfinylbutyldesulfoglucosinolate
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CAS No:
DESULFOGLUCORAPHANIN Use and Manufacturing
Glucosinolate analog of Glucoraphanin found in cruciferous vegetables such as broccoli and cauliflower.
Computed Properties
Molecular Weight:357.4
XLogP3:-1.5
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:8
Exact Mass:357.09159442
Monoisotopic Mass:357.09159442
Topological Polar Surface Area:184
Heavy Atom Count:22
Complexity:396
Defined Atom Stereocenter Count:3
Undefined Atom Stereocenter Count:3
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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