public_id

FDB000638

IUPAC 名称

2,6-dimethoxy-9,10-dihydrophenanthrene-4,5-diol

描述

Cannithrene 2 is a member of the class of compounds known as hydrophenanthrenes. Hydrophenanthrenes are a phenanthrene derivative where at least one ring CC bond is substituted by hydrogenation. Cannithrene 2 is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Cannithrene 2 can be found in black crowberry, which makes cannithrene 2 a potential biomarker for the consumption of this food product.

CAS号

83016-16-4

异构

COC1=CC2=C(C(O)=C1)C1=C(CC2)C=CC(OC)=C1O

InChI标识符

InChI=1S/C16H16O4/c1-19-11-7-10-4-3-9-5-6-13(20-2)16(18)15(9)14(10)12(17)8-11/h5-8,17-18H,3-4H2,1-2H3

键

JOPGVVOTXYNMIS-UHFFFAOYSA-N

平均分子量

272.104859

id

638

含有化合物的食物

食物id	食物名称
75	Black crowberry