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CHEBI:71162 - pyrrole-3,4-dicarboxylic acid

ChEBI IDCHEBI:71162
ChEBI Namepyrrole-3,4-dicarboxylic acid
Stars
DefinitionA pyrroledicarboxylic acid in which the two carboxy groups are located at positions 3 and 4.
Last Modified28 November 2012
Submittermwilliams
DownloadsMolfile
FormulaC6H5NO4
Net Charge0
Average Mass155.109
Monoisotopic Mass155.02186
SMILESO=C(O)c1cncc1C(=O)O
InChIInChI=1S/C6H5NO4/c8-5(9)3-1-7-2-4(3)6(10)11/h1-2,7H,(H,8,9)(H,10,11)
InChIKeyJFVDNCRMBALUKH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
pyrrole-3,4-dicarboxylic acid (CHEBI:71162) has role metabolite (CHEBI:25212)
pyrrole-3,4-dicarboxylic acid (CHEBI:71162) is a pyrroledicarboxylic acid (CHEBI:59197)
IUPAC Name 
1H-pyrrole-3,4-dicarboxylic acid
Registry NumbersSources
Reaxys:128615Reaxys
Citations