public_id

FDB005148

IUPAC 名称

4-[(3-methylbut-2-en-1-yl)oxy]benzoic acid

描述

Valencic acid, also known as valencate, is a member of the class of compounds known as benzoic acids. Benzoic acids are organic Compounds containing a benzene ring which bears at least one carboxyl group. Valencic acid is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Valencic acid can be found in sweet orange, which makes valencic acid a potential biomarker for the consumption of this food product.

CAS号

异构

CC(C)=CCOC1=CC=C(C=C1)C(O)=O

InChI标识符

InChI=1S/C12H14O3/c1-9(2)7-8-15-11-5-3-10(4-6-11)12(13)14/h3-7H,8H2,1-2H3,(H,13,14)

键

KLZJDQVTNOMAKU-UHFFFAOYSA-N

平均分子量

206.094294314

id

5149

含有化合物的食物

食物id	食物名称
57	Sweet orange