public_id

FDB017770

IUPAC 名称

{[(E)-(3-hydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}hex-5-en-1-ylidene)amino]oxy}sulfonic acid

描述

Gluconapoleiferin is a member of the class of compounds known as alkylglucosinolates. Alkylglucosinolates are organic compounds containing a glucosinolate moiety that carries an alkyl chain. Gluconapoleiferin is soluble (in water) and an extremely strong acidic compound (based on its pKa). Gluconapoleiferin can be found in a number of food items such as swede, broccoli, chinese cabbage, and turnip, which makes gluconapoleiferin a potential biomarker for the consumption of these food products.

CAS号

19764-03-5

异构

OCC1OC(S\C(CC(O)CC=C)=N\OS(O)(=O)=O)C(O)C(O)C1O

InChI标识符

InChI=1S/C12H21NO10S2/c1-2-3-6(15)4-8(13-23-25(19,20)21)24-12-11(18)10(17)9(16)7(5-14)22-12/h2,6-7,9-12,14-18H,1,3-5H2,(H,19,20,21)/b13-8+

键

ZEGLQSKFSKZGRO-MDWZMJQESA-N

平均分子量

403.060687277

id

17777

含有化合物的食物

食物id	食物名称
36	Turnip
28	Swede
77	Rocket salad (ssp.)
244	Rocket salad
395	Kale
18	Horseradish
27	Chinese mustard
35	Chinese cabbage
31	Cauliflower
39	Capers
34	Broccoli