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585-95-5

585-95-5 Structure

585-95-5 Structure
IdentificationBack Directory
[Name]

Progoitrin
[CAS]

585-95-5
[Synonyms]

Glucorapiferin
progoitrin(1-)
2(R)-Hydroxy-3-butenyl glucosinolate
(R)-2-Hydroxy-3-butenyl glucosinolate
1-[(R)-1-[(Sulfooxy)imino]-3-hydroxy-4-pentenyl]-1-thio-β-D-glucopyranose
β-D-Glucopyranose, 1-thio-, 1-[(3R)-3-hydroxy-N-(sulfooxy)-4-pentenimidate]
beta-D-Glucopyranose, 1-thio-, 1-((3R)-3-hydroxy-N-(sulfooxy)-4-pentenimidate
beta-D-Glucopyranose, 1-thio-, 1-(3-hydroxy-N-(sulfooxy)-4-pentenimidate), (R)-
Glucopyranose, 1-thio-, 1-((R)-3-hydroxy-4-pentenohydroximate) no-(hydrogen sulfate), beta-D-
[Molecular Formula]

C11H19NO10S2
[MDL Number]

MFCD09752815
[MOL File]

585-95-5.mol
[Molecular Weight]

389.4
Chemical PropertiesBack Directory
[density ]

1.79±0.1 g/cm3(Predicted)
[form ]

Solid
[Melting point ]

178-181 °C
[pka]

-3.13±0.18(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

Progoitrin is the dominant glucosinolate in incriminated crops. Antithyroid activity[1][2].
[Definition]

ChEBI: The stereoisomer of xi-progoitrin that has R at the carbon bearing the allylic hydroxy group.
[References]

[1] Collett MG, et al. Hepatotoxicity of Two Progoitrin-Derived Nitriles in New Zealand White Rabbits. Toxins (Basel). 2020;12(11):695. Published 2020 Nov 2. DOI:10.3390/toxins12110695
[2] GREER MA, et al. Antithyroid activity elicited by the ingestion of pure progoitrin, a naturally occurring thioglycoside of the turnip family. J Clin Invest. 1959;38(9):1465-1474. DOI:10.1172/JCI103923
Spectrum DetailBack Directory
[Spectrum Detail]

Progoitrin(585-95-5)1HNMR
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