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CHEBI:194905 - 2-(Methylthio)nicotinic acid

Default Structure
ChEBI IDCHEBI:194905
ChEBI Name2-(Methylthio)nicotinic acid
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SubmitterMetaboLights
DownloadsMolfile
FormulaC7H7NO2S
Net Charge0
Average Mass169.205
Monoisotopic Mass169.01975
SMILESCSc1ncccc1C(=O)O
InChIInChI=1S/C7H7NO2S/c1-11-6-5(7(9)10)3-2-4-8-6/h2-4H,1H3,(H,9,10)
InChIKeyCOPSJQVPEUUOKY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-(Methylthio)nicotinic acid (CHEBI:194905) is a aromatic carboxylic acid (CHEBI:33859)
2-(Methylthio)nicotinic acid (CHEBI:194905) is a pyridines (CHEBI:26421)
IUPAC Name 
2-methylsulanylpyridine-3-carboxylic acid
Manual XrefsDatabases
230436ChemSpider