public_id

FDB003895

IUPAC 名称

3-butyl-1,3,4,5-tetrahydro-2-benzofuran-1-one

描述

3-n-butyl-4,5-dihydrophthalide, also known as nbpa or sedanenolide, is a member of the class of compounds known as isobenzofurans. Isobenzofurans are organic aromatic compounds containing an isobenzofuran moiety. 3-n-butyl-4,5-dihydrophthalide is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 3-n-butyl-4,5-dihydrophthalide is a herbal tasting compound found in dill, lovage, parsley, and wild celery, which makes 3-n-butyl-4,5-dihydrophthalide a potential biomarker for the consumption of these food products.

CAS号

62006-39-7

异构

CCCCC1OC(=O)C2=C1CCC=C2

InChI标识符

InChI=1S/C12H16O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7,11H,2-4,6,8H2,1H3

键

ZPIKVDODKLJKIN-UHFFFAOYSA-N

平均分子量

192.115029756

id

3896

含有化合物的食物

食物id	食物名称
15	Wild celery
131	Parsley
100	Lovage
13	Dill
215	Celery stalks
214	Celeriac