public_id

FDB005065

IUPAC 名称

7-methoxy-6-(3-methylbut-2-en-1-yl)-2H-chromen-2-one

描述

Suberosin, also known as 7-methoxy-6-prenylcoumarin, belongs to coumarins and derivatives class of compounds. Those are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). Suberosin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Suberosin can be found in lemon, mandarin orange (clementine, tangerine), and sweet orange, which makes suberosin a potential biomarker for the consumption of these food products.

CAS号

581-31-7

异构

COC1=C(CC=C(C)C)C=C2C=CC(=O)OC2=C1

InChI标识符

InChI=1S/C15H16O3/c1-10(2)4-5-11-8-12-6-7-15(16)18-14(12)9-13(11)17-3/h4,6-9H,5H2,1-3H3

键

RSZDAYHEZSRVHS-UHFFFAOYSA-N

平均分子量

244.109944378

id

5066

含有化合物的食物

食物id	食物名称
57	Sweet orange
56	Mandarin orange (Clementine, Tangerine)
54	Lemon