U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C9H9NO5
Molecular Weight 211.1715
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GENTISURIC ACID

SMILES

OC(=O)CNC(=O)C1=CC(O)=CC=C1O

InChI

InChIKey=FBFATOOJCPDQOZ-UHFFFAOYSA-N
InChI=1S/C9H9NO5/c11-5-1-2-7(12)6(3-5)9(15)10-4-8(13)14/h1-3,11-12H,4H2,(H,10,15)(H,13,14)

HIDE SMILES / InChI

Molecular Formula C9H9NO5
Molecular Weight 211.1715
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:44:40 GMT 2023
Edited
by admin
on Sat Dec 16 15:44:40 GMT 2023
Record UNII
45RYS5R5SJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GENTISURIC ACID
Common Name English
N-(2,5-DIHYDROXYBENZOYL)GLYCINE
Systematic Name English
((2,5-DIHYDROXYBENZOYL)AMINO)ACETIC ACID
Systematic Name English
2-((2,5-DIHYDROXYPHENYL)FORMAMIDO)ACETIC ACID
Systematic Name English
GLYCINE, N-(2,5-DIHYDROXYBENZOYL)-
Systematic Name English
2-((2,5-BIS(OXIDANYL)PHENYL)CARBONYLAMINO)ETHANOIC ACID
Systematic Name English
Code System Code Type Description
CAS
25351-24-0
Created by admin on Sat Dec 16 15:44:40 GMT 2023 , Edited by admin on Sat Dec 16 15:44:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID10179998
Created by admin on Sat Dec 16 15:44:40 GMT 2023 , Edited by admin on Sat Dec 16 15:44:40 GMT 2023
PRIMARY
FDA UNII
45RYS5R5SJ
Created by admin on Sat Dec 16 15:44:40 GMT 2023 , Edited by admin on Sat Dec 16 15:44:40 GMT 2023
PRIMARY
PUBCHEM
161488
Created by admin on Sat Dec 16 15:44:40 GMT 2023 , Edited by admin on Sat Dec 16 15:44:40 GMT 2023
PRIMARY