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AG003U9V

3952-98-5 | Sinigrin

Chemical structure of Sinigrin, CAS 3952-98-5
AG003U9V
sdsSDS
sdsCOA

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CAS Number 3952-98-5
Catalog Number AG003U9V(AGN-PC-0RJZJG)
Chemical Name Sinigrin
EC Number 223-545-8
IUPAC Name potassium;[(E)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanylbut-3-enylideneamino] sulfate
InChI InChI=1S/C10H17NO9S2.K/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10;/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18);/q;+1/p-1/b11-6+;/t5-,7-,8+,9-,10+;/m1./s1
InChI Key QKFAFSGJTMHRRY-OCFLFPRFSA-M
MDL Number MFCD00149447
Molecular Formula C10H16KNO9S2
Molecular Weight 397.4636
SMILES O[C@H]1[C@H](S/C(CC=C)=N/OS(=O)([O-])=O)O[C@H](CO)[C@@H](O)[C@@H]1O.[K+]
Synonyms
myronate, sinigrin, sinigrin, monopotassium salt, Sinigrin, Sinigrin hydrate, Allyl glucosinolate, 3952-98-5, CCRIS 3715, Glucoside of allyl isothiocyanate, EINECS 223-545-8, NSC 90774, NSC 407279, Potassium 1-(beta-D-glucopyranosylthio)but-3-enylideneaminooxysulphonate, SCHEMBL17239385, Glucopyranose, 1-thio-, 1-(3-butenohydroximate) NO-(hydrogensulfate), monopotassium salt, beta-D-, MFCD00006616, MFCD00149447, API0004182, LS-71494, S0156, 64550-88-5, beta-D-Glucopyranose, 1-thio-, 1-(N-(sulfooxy)-3-butenimidate), monopotassium salt, Glucopyranose, 1-thio-, 1-(3-butenohydroximate) NO-(hydrogen sulfate), monopotassium salt, beta-D-, sinigroside, 2-Propenyl glucosinolate, UNII-50UM64RMBJ, C10H17NO9S2.K, C10-H17-N-O9-S2.K, ACN-047357, CID9571118, .beta.-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)-3-butenimidate], monopotassium salt, 1-Thio-beta-D-glucopyranose 1-[N-(sulfooxy)-3-butenimidate] monopotassium salt, Glucopyranose, 1-thio-, 1-(3-butenohydroximate) NO-(hydrogen sulfate), monopotassium salt, .beta.-D-,

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    Conclusion: The above product meets the specifications of Angene.
    Analyst:Chase
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    Reviewed by:Jessie
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    Angene International Limited