public_id

FDB008869

IUPAC 名称

3,4-dimethylbenzoic acid

描述

Isolated from Eryngium foetidum (culantro) Trimethylobenzene is metabolized mainly to dimethylbenzoic (DMBA) acid. Trimethylobenzene (TMB) is a common ingredient of many organic solvents used in industry. DMBA and dimethylhippuric (DMHA) acids, excreted in urine can be used as biological indicators of exposure to TMB. (PMID: 8170375 ). 3,4-Dimethylbenzoic acid is found in herbs and spices.

CAS号

619-04-5

异构

CC1=C(C)C=C(C=C1)C(O)=O

InChI标识符

InChI=1S/C9H10O2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H,10,11)

键

OPVAJFQBSDUNQA-UHFFFAOYSA-N

平均分子量

150.068079564

id

8870

含有化合物的食物

食物id	食物名称
353	Mule deer
595	Mountain hare
358	Mallard duck
383	Horse
897	Herbs and Spices
378	Guinea hen
373	Greylag goose
451	European rabbit
365	Emu
364	Elk
549	Domestic pig
541	Domestic goat
535	Deer
624	Columbidae (Dove, Pigeon)
334	Chicken
506	Cattle (Beef, Veal)
316	Buffalo
303	Bison
542	Beefalo
590	Anatidae