public_id

FDB030634

IUPAC 名称

2-{[1-(hydroxyimino)-9-(methylsulfanyl)nonyl]sulfanyl}-6-(hydroxymethyl)oxane-3,4,5-triol

描述

8-methylthiooctyldesulfoglucosinolate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 8-methylthiooctyldesulfoglucosinolate can be found in a number of food items such as hedge mustard, borage, bog bilberry, and garden onion (variety), which makes 8-methylthiooctyldesulfoglucosinolate a potential biomarker for the consumption of these food products.

CAS号

异构

CSCCCCCCCCC(SC1OC(CO)C(O)C(O)C1O)=NO

InChI标识符

InChI=1S/C16H31NO6S2/c1-24-9-7-5-3-2-4-6-8-12(17-22)25-16-15(21)14(20)13(19)11(10-18)23-16/h11,13-16,18-22H,2-10H2,1H3

键

JXHZTRXZIXRIDX-UHFFFAOYSA-N

平均分子量

397.15928007

id

30797

含有化合物的食物

食物id	食物名称
137	Anise
1	Angelica
445	American pokeweed
192	American cranberry
319	American butterfish
289	Amaranth
412	Alpine sweetvetch
148	Almond
288	Allspice
5	Allium
287	Alfalfa
551	Alaska wild rhubarb
385	Alaska blueberry
577	Agave
285	Agar
198	Adzuki bean
283	Acorn
282	Acerola
281	Abiyuch
280	Abalone