public_id

FDB005802

IUPAC 名称

2-(6-amino-8-chloro-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol

描述

Calamene is a member of the class of compounds known as purine nucleosides. Purine nucleosides are compounds comprising a purine base attached to a ribosyl or deoxyribosyl moiety. Calamene is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Calamene can be found in a number of food items such as common oregano, star anise, german camomile, and sweet bay, which makes calamene a potential biomarker for the consumption of these food products.

CAS号

异构

NC1=NC=NC2=C1N=C(Cl)N2C1OC(CO)C(O)C1O

InChI标识符

InChI=1S/C10H12ClN5O4/c11-10-15-4-7(12)13-2-14-8(4)16(10)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,13,14)

键

MHDPPLULTMGBSI-UHFFFAOYSA-N

平均分子量

301.057781604

id

5803

含有化合物的食物

食物id	食物名称
97	Sweet bay
119	Sweet basil
90	Star anise
139	Pepper (Spice)
107	German camomile
165	Common sage
124	Common oregano