1-sulfur-1-[N-(sulfoxy)-3-butenedioate]-β-D-glucuronicacidmonopotassiumsalt(9CI), 99%

cas: 3952-98-5 — see every product listed under this CAS number, including other names

1-sulfur-1-[N-(sulfoxy)-3-butenedioate]-β-D-glucuronicacidmonopotassiumsalt(9CI), 99% (CAS 3952-98-5) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 10mg, 50mg, 100mg, 250mg. Offered by: Chemat.

• 2D
• 3D

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate (CAS 3952-98-5) is a chemical compound with the molecular formula C10H17NO9S2 and a molecular weight of 359.4 g/mol. IUPAC name: [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate. InChIKey: PHZOWSSBXJXFOR-PTGZALFTSA-N.

Identity

Molecular formula	C10H17NO9S2
Molecular weight	359.4 g/mol
IUPAC name	[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate
InChIKey	PHZOWSSBXJXFOR-PTGZALFTSA-N
SMILES	C=CC/C(=N\OS(=O)(=O)O)/S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O

Computed by PubChem (NCBI)

Synonyms: Myronate, Sinigrin, Myronic acid, Allyl glucosinolate, propenyl glucosinolate, .beta.-D-Glucopyranose, 1-thio-, 1-[N-(sulfooxy)-3-butenimidate], 1-Thio-b-D-glucopyranose 1-[N-(sulfooxy)-3-butenimidate], 9CI, beta-D-Glucopyranose, 1-thio-, 1-(N-(sulfooxy)-3-butenimidate)

Related forms of this compound

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxybut-3-enimidothioate C₁₀H₁₇NO₉S₂