3-Methylhippuric acid

3-Methylhippuric acid is also referred as m-methyl-hippuric acid. It is major product of xylene biotransformation in urine.

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Catalog Number CBB1115534
Alternative Name(s) m-Toluric acid; N-(3-Methylbenzoyl)glycine
Molecular Formula CH3C6H4CONHCH2CO2H
CAS# 27115-49-7
Purity >98%
Inchi 1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)
Inchi Key YKAKNMHEIJUKEX-UHFFFAOYSA-N
SMILES Cc1cccc(c1)C(=O)NCC(O)=O
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