β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt
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![β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/8f2aaf282b8c4001ae49cf16edf88308.png "β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt")
β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt
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CAS No:
5115-71-9
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Formula:
C14H19NO9S2.K
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Chemical Name:
β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt
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Synonyms:
β-D-Glucopyranose,1-thio-,1-[N-(sulfooxy)benzeneethanimidate],monopotassium salt;Glucopyranose,1-thio-,1-(2-phenylacetohydroximate) NO-(hydrogen sulfate),monopotassium salt,β-D-;Glucopyranose,1-thio-,1-(phenylacetate),oxime,O-sulfate,potassium salt,β-D-;Glucopyranose,1-thio-,S-phenylacetate,oxime,hydrogen sulfate,potassium salt,β-D-;Glucotropaeolin,potassium salt;31014-90-1
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CAS No:
Description
Glucotropaeolin potassium (Benzylglucosinolate potassium) , a glucosinolate contained in cruciferous vegetables, causes a moderate decrease in spontaneous DNA damage in animals[1].
β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)benzeneethanimidate], monopotassium salt Basic Attributes
447.52
447.006012
610-625-6
DTXSID40743984
Computed Properties
Molecular Weight:447.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:447.00600498
Monoisotopic Mass:447.00600498
Topological Polar Surface Area:203
Heavy Atom Count:27
Complexity:580
Defined Atom Stereocenter Count:5
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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