ChemicalBook--->CAS DataBase List--->4356-52-9

4356-52-9

4356-52-9 Structure

4356-52-9 Structure
IdentificationBack Directory
[Name]

glucobrassicin
[CAS]

4356-52-9
[Synonyms]

glucobrassicin
3-INDOLYLMETHYLGLUCOSINOLATE
Indole-3-methyl glucosinolate
2-(1H-Indole-3-yl)-1-(sulfooxyimino)ethyl 1-thio-β-D-glucopyranoside
β-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)-1H-indole-3-ethanimidate]
1-S-[1-(Sulfooxyimino)-2-(1H-indole-3-yl)ethyl]-1-thio-β-D-glucopyranose
1-Thio-β-D-glucopyranose 1-[N-(hydroxysulfonyloxy)-1H-indole-3-ethane-1-imidate]
Sulfuric acid O-[1-(β-D-glucopyranosylthio)-2-(1H-indol-3-yl)ethylideneamino] ester
[Molecular Formula]

C16H20N2O9S2
[MOL File]

4356-52-9.mol
[Molecular Weight]

448.47
Chemical PropertiesBack Directory
[Melting point ]

149-150 °C
[density ]

1.80±0.1 g/cm3(Predicted)
[pka]

-3.05±0.18(Predicted)
Hazard InformationBack Directory
[Uses]

Glucobrassicin is a glucosinolate (GSL) isolated from wild carrot (Raphanus raphanistrum L.). Glucobrassicin can be used in biological fumigation or allelopathy research for weed management[1].
[Definition]

ChEBI: An indolylmethylglucosinolic acid that is 1-thio-beta-D-glucopyranose having a 2-(1H-indol-3-yl)-N-(sulfooxy)ethanimidoyl group attached to the anomeric sulfur.
[References]

[1] Malik, Mayank S et al. Glucosinolate profile variation of growth stages of wild radish DOI:10.1021/jf100258c
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