CHEBI:194827 - 3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid
ChEBI ID CHEBI:194827
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C9H7NO2S
Net Charge 0
Average Mass 193.220
Monoisotopic Mass 193.01975
InChI InChI=1S/C9H7NO2S/c11-9(12)8-7(3-6-13-8)10-4-1-2-5-10/h1-6H,(H,11,12)
InChIKey WSCYUZJLJQNLSQ-UHFFFAOYSA-N
SMILES S1C(=C(N2C=CC=C2)C=C1)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 3-(1H-pyrrol-1-yl)thiophene-2-carboxylic acid (CHEBI:194827) is a thiophenecarboxylic acid (CHEBI:48436)
IUPAC Name
3-pyrrol-1-ylthiophene-2-carboxylic acid
Manual Xref Database
2056848 ChemSpider
View more database links