CHEBI:36751 - pyrrole-2-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pyrrole-2-carboxylic acid
ChEBI ID CHEBI:36751
Definition A pyrrolecarboxylic acid that is 1H-pyrrole carrying a carboxy substituent at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:8684, CHEBI:26453
Supplier Information
Download Molfile XML SDF
Formula C5H5NO2
Net Charge 0
Average Mass 111.09874
Monoisotopic Mass 111.032
InChI InChI=1S/C5H5NO2/c7-5(8)4-2-1-3-6-4/h1-3,6H,(H,7,8)
InChIKey WRHZVMBBRYBTKZ-UHFFFAOYSA-N
SMILES OC(=O)c1ccc[nH]1
Metabolite of Species Details
Brachystemma calycinum (IPNI:151926-1) Found in aerial part (BTO:0001658). 95% aqueous ethanolic extract of sun-dreid and powdered aerial parts See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing pyrrole-2-carboxylic acid (CHEBI:36751) has role plant metabolite (CHEBI:76924)
pyrrole-2-carboxylic acid (CHEBI:36751) is a pyrrolecarboxylic acid (CHEBI:26454)
pyrrole-2-carboxylic acid (CHEBI:36751) is conjugate acid of pyrrole-2-carboxylate (CHEBI:27660)
Incoming pyrrole-2-carboxylate (CHEBI:27660) is conjugate base of pyrrole-2-carboxylic acid (CHEBI:36751)
IUPAC Name
1H-pyrrole-2-carboxylic acid
Synonyms Sources
2-pyrrolecarboxylic acid ChemIDplus
Minaline ChemIDplus
PCA NIST Chemistry WebBook
Pyrrole-2-carboxylate KEGG COMPOUND
pyrrole-2-carboxylic acid NIST Chemistry WebBook
Database Links Databases
C05942 KEGG COMPOUND
DB02543 DrugBank
PYC PDBeChem
View more database links
Registry Numbers Types Sources
101562 Gmelin Registry Number Gmelin
634-97-9 CAS Registry Number ChemIDplus
634-97-9 CAS Registry Number NIST Chemistry WebBook
80825 Beilstein Registry Number Beilstein
Citation Waiting for Citations Type Source
21634415 PubMed citation Europe PMC
Last Modified
23 October 2015