CAS 43110-92-5

Desulfoglucobrassicin

Description:

Desulfoglucobrassicin is a naturally occurring compound classified as a glucosinolate, which is a type of sulfur-containing compound found primarily in cruciferous vegetables. It is notable for its role in plant defense mechanisms and its potential health benefits. The chemical structure of desulfoglucobrassicin includes a glucose moiety linked to a sulfur-containing aglycone, which contributes to its biological activity. This compound is of interest in the field of phytochemistry and nutrition due to its possible anticancer properties and its involvement in the modulation of various biological pathways. Desulfoglucobrassicin is also studied for its potential effects on human health, particularly in relation to its antioxidant properties and its role in detoxification processes. As with many glucosinolates, the breakdown products of desulfoglucobrassicin can have significant biological effects, making it a subject of research in both agricultural and medicinal contexts. Its CAS number, 43110-92-5, is used for identification in chemical databases and regulatory frameworks.

Formula: C₁₆H₂₀N₂O₆S

InChI: InChI=1S/C16H20N2O6S/c19-7-11-13(20)14(21)15(22)16(24-11)25-12(18-23)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-23H,5,7H2/t11-,13-,14+,15-,16+/m1/s1

InChI key: InChIKey=CWNIQCOMWQROPA-JZYAIQKZSA-N

SMILES: C(C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NO)C=2C=3C(NC2)=CC=CC3

Synonyms:

• β-D-Glucopyranose, 1-thio-, 1-(N-hydroxy-1H-indole-3-ethanimidate)
• 3-Indolylmethyldesulfoglucosinolate
• Desulfoglucobrassicin
• Desulfoglucobrassicanapin

Desulfoglucobrassicin

CAS: 43110-92-5

Desulfoglucobrassicin analytical standard provided with w/w absolute assay, to be used for quantitative titration.

Formula: C₁₆H₂₀N₂O₆S

Purity: (HPLC) ≥97%

Color and Shape: Powder

Molecular weight: 368.41

Ref: 11-2527S