Sinigrine

CAS: 3952-98-5

Ref. TR-S487350

Información del producto

• Nombre: Sinigrine
• Sinónimos: 1-Thio-β-D-glucopyranose 1-[N-(Sulfooxy)-3-butenimidate] Potassium Salt (1:1), 1-Thioglucopyranose 1-(3-Butenohydroximate) NO-(Hydrogen sulfate) Monopotassium Salt, 1-Thio-β-D-glucopyranose 1-[N-(sulfooxy)-3-butenimidate] Monopotassium Salt, 2-Propenyl Glucosinolate, Allyl Glucosinolate Potassium, NSC 407279, NSC 90774, Sinigrin, 1-S-[(1E)-N-(sulfonatooxy)but-3-enimidoyl]-1-thio-beta-D-glucopyranose, 2-Propenyl glucosinolate, Allyl glucosinolate potassium, Glucopyranose, 1-thio-, 1-(3-butenoate), oxime, O-sulfate, potassium salt, β-<span class="text-smallcaps">D</span>-, Glucopyranose, 1-thio-, 1-(3-butenohydroximate) NO-(hydrogen sulfate), monopotassium salt, β-<span class="text-smallcaps">D</span>-, Sinigrin monohydrate from horseradish, Tritium, potassium 1-(beta-D-glucopyranosylthio)but-3-enylideneaminooxysulphonate, potassium 1-S-[(1Z)-N-(sulfonatooxy)but-3-enimidoyl]-1-thio-beta-D-glucopyranose, β-<span class="text-smallcaps">D</span>-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)-3-butenimidate], monopotassium salt, β-<span class="text-smallcaps">D</span>-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)-3-butenimidate], potassium salt (1:1)
• CAS: 3952-98-5

Descripción

Applications Sinigrine, is a glucosinolate which is found naturally in Cruciferae including the genus Brassica. When enzymatically hydrolysed, Sinigrine yields isothiocyanates and give a pungent taste. Both Sinigrine, and isothiocyanates, have been shown to have anticancer activity as well as antifungal and antibacterial properties.
References Cools, K., et al.: J. Chromatograohy B., 901, 115 (2012); Okullcz, M., et al.: Materiae Veg., 65 (3), 217 2010;

• Marca: TRC

Propiedades químicas

• Peso molecular: 397.46
• Fórmula: C₁₀H₁₆KNO₉S₂
• Color/Forma: White Solid
• InChI: /m1./s1, 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, /q, /t5-,7-,8+,9-,10+, +1/p-1/b11-6+, /h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)
• Clave InChI: InChIKey=QKFAFSGJTMHRRY-OCFLFPRFSA-M
• SMILES: C=CC/C(=N\OS(=O)(=O)O[K])S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O