MSI_000025712

Unreliable

排名分数: 2.16
参考来源: Mus musculus (UBERON:0000913: interstitial fluid)

M/z: 496.1185
Mass Window: 496.1185 ~ 496.1185 (none)

参考注释

7-methylsulfinylheptyl glucosinolate_[M+NH4]+ (BioDeep_00000228938)
2-(hydroxymethyl)-6-({8-methanesulfinyl-1-[(sulfonatooxy)imino]octyl}sulfanyl)oxane-3,4,5-triol

Formula: C15H28NO10S3 (478.08752880000003)
SMILES: CS(=O)CCCCCCCC(SC1OC(CO)C(O)C(O)C1O)=NOS([O-])(=O)=O

7-methylsulfinylheptyl glucosinolate is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 7-methylsulfinylheptyl glucosinolate can be found in a number of food items such as kumquat, chinese cabbage, medlar, and banana, which makes 7-methylsulfinylheptyl glucosinolate a potential biomarker for the consumption of these food products.