4-((1S)-2-HYDROXY-1-METHYL-2-OXO-ETHYL)BENZOIC ACID

C[C@H](C(O)=O)C1=CC=C(C=C1)C(O)=O

InChIKey=ZHJJCJKDNFTHKD-LURJTMIESA-N

InChI=1S/C10H10O4/c1-6(9(11)12)7-2-4-8(5-3-7)10(13)14/h2-6H,1H3,(H,11,12)(H,13,14)/t6-/m0/s1

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Substance Class	Chemical Created by `admin` on `Tue Apr 01 20:52:32 GMT 2025` Edited by `admin` on `Tue Apr 01 20:52:32 GMT 2025`
Record UNII	LCJ4RS3NLE
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

BENZENEACETIC ACID, 4-CARBOXY-.ALPHA.-METHYL-, (S)-

Preferred Name

English

4-((1S)-2-HYDROXY-1-METHYL-2-OXO-ETHYL)BENZOIC ACID

Common Name

English

Code System Code Type Description

PUBCHEM

13123221

Created by admin on Tue Apr 01 20:52:32 GMT 2025 , Edited by admin on Tue Apr 01 20:52:32 GMT 2025

PRIMARY

FDA UNII

LCJ4RS3NLE

Created by admin on Tue Apr 01 20:52:32 GMT 2025 , Edited by admin on Tue Apr 01 20:52:32 GMT 2025

PRIMARY

CAS

145679-14-7

Created by admin on Tue Apr 01 20:52:32 GMT 2025 , Edited by admin on Tue Apr 01 20:52:32 GMT 2025

PRIMARY

Related Record Type Details


					671DKG7P5S

PARENT -> METABOLITE INACTIVE

Comments:

Metabolism by CYP2C9 (90%) and CYP2C19 (10%).