public_id

FDB008102

IUPAC 名称

methyl 3-hydroxy-3-methylbutanoate

描述

Methyl 3-hydroxyisovalerate is a member of the class of compounds known as fatty acid methyl esters. Fatty acid methyl esters are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail or organyl group and R'=methyl group. Methyl 3-hydroxyisovalerate is soluble (in water) and an extremely weak acidic compound (based on its pKa). Methyl 3-hydroxyisovalerate can be found in bilberry and black walnut, which makes methyl 3-hydroxyisovalerate a potential biomarker for the consumption of these food products.

CAS号

6149-45-7

异构

COC(=O)CC(C)(C)O

InChI标识符

InChI=1S/C6H12O3/c1-6(2,8)4-5(7)9-3/h8H,4H2,1-3H3

键

JNURPEZKOSMRMZ-UHFFFAOYSA-N

平均分子量

132.07864425

id

8103

含有化合物的食物

食物id	食物名称
93	Black walnut
193	Bilberry