public_id

FDB004505

IUPAC 名称

(3E)-hex-3-en-1-yl butanoate

描述

Butanoic acid 3-hexenyl ester is a member of the class of compounds known as fatty acid esters. Fatty acid esters are carboxylic ester derivatives of a fatty acid. Butanoic acid 3-hexenyl ester is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Butanoic acid 3-hexenyl ester can be found in soy bean, which makes butanoic acid 3-hexenyl ester a potential biomarker for the consumption of this food product.

CAS号

异构

[H]\C(CC)=C(\[H])CCOC(=O)CCC

InChI标识符

InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5+

键

ZCHOPXVYTWUHDS-AATRIKPKSA-N

平均分子量

170.13067982

id

4506

含有化合物的食物

食物id	食物名称
38	Tea
957	Red tea
1021	Herbal tea
940	Green tea
939	Black tea