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Details

Stereochemistry ACHIRAL
Molecular Formula C13H11NO5
Molecular Weight 261.2301
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(2-FORMYL-5-(HYDROXYMETHYL)-1H-PYRROL-1-YL)-2-HYDROXYBENZOIC ACID

SMILES

OCC1=CC=C(C=O)N1C2=CC(C(O)=O)=C(O)C=C2

InChI

InChIKey=VUXRLABGWNUXQB-UHFFFAOYSA-N
InChI=1S/C13H11NO5/c15-6-9-1-2-10(7-16)14(9)8-3-4-12(17)11(5-8)13(18)19/h1-6,16-17H,7H2,(H,18,19)

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
5-(2-FORMYL-5-(HYDROXYMETHYL)-1H-PYRROL-1-YL)-2-HYDROXYBENZOIC ACID
Systematic Name English
BENZOIC ACID, 5-(2-FORMYL-5-(HYDROXYMETHYL)-1H-PYRROL-1-YL)-2-HYDROXY-
Preferred Name English
Code System Code Type Description
PUBCHEM
71405644
Created by admin on Wed Apr 02 09:07:00 GMT 2025 , Edited by admin on Wed Apr 02 09:07:00 GMT 2025
PRIMARY
FDA UNII
84588S33E9
Created by admin on Wed Apr 02 09:07:00 GMT 2025 , Edited by admin on Wed Apr 02 09:07:00 GMT 2025
PRIMARY
NIH
NCATS
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