2-Hydroxy-3,4-dimethoxy-6-methyl-5-(sulfooxy)benzenebutanoic acid

COC1=C(O)C(CCCC(O)=O)=C(C)C(OS(O)(=O)=O)=C1OC

InChIKey=RAFOUZXLFLDEAM-UHFFFAOYSA-N

InChI=1S/C13H18O9S/c1-7-8(5-4-6-9(14)15)10(16)12(20-2)13(21-3)11(7)22-23(17,18)19/h16H,4-6H2,1-3H3,(H,14,15)(H,17,18,19)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:56:29 GMT 2025` Edited by `admin` on `Wed Apr 02 20:56:29 GMT 2025`
Record UNII	Q6A8C63DZB
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

2-Hydroxy-3,4-dimethoxy-6-methyl-5-(sulfooxy)benzenebutanoic acid

Systematic Name

English

2H-QS-4 Sulfate

Preferred Name

English

4-(2-Hydroxy-3,4-dimethoxy-6-methyl-5-sulfooxyphenyl)butanoic acid

Systematic Name

English

Benzenebutanoic acid, 2-hydroxy-3,4-dimethoxy-6-methyl-5-(sulfooxy)-

Systematic Name

English

Code System Code Type Description

FDA UNII

Q6A8C63DZB

Created by admin on Wed Apr 02 20:56:29 GMT 2025 , Edited by admin on Wed Apr 02 20:56:29 GMT 2025

PRIMARY

PUBCHEM

13579937

Created by admin on Wed Apr 02 20:56:29 GMT 2025 , Edited by admin on Wed Apr 02 20:56:29 GMT 2025

PRIMARY

CAS

121715-57-9

Created by admin on Wed Apr 02 20:56:29 GMT 2025 , Edited by admin on Wed Apr 02 20:56:29 GMT 2025

PRIMARY

Related Record Type Details


					79R5BY5QJZ

SALT/SOLVATE -> PARENT

Amount: