CHEBI:193989 - 3-(3-methoxyphenyl)-2-oxopropanoic acid

ChEBI IDCHEBI:193989
ChEBI Name3-(3-methoxyphenyl)-2-oxopropanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O4
Net Charge0
Average Mass194.186
Monoisotopic Mass194.05791
SMILESCOc1cccc(CC(=O)C(=O)O)c1
InChIInChI=1S/C10H10O4/c1-14-8-4-2-3-7(5-8)6-9(11)10(12)13/h2-5H,6H2,1H3,(H,12,13)
InChIKeyQRICSZPYENRNSS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
synthetic microbial community (ncbitaxon:3229850) Whole Organism (NCIT:C13413) MetaboLights (MTBLS3129)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3-(3-methoxyphenyl)-2-oxopropanoic acid (CHEBI:193989) has functional parent pyruvic acid (CHEBI:32816)
3-(3-methoxyphenyl)-2-oxopropanoic acid (CHEBI:193989) is a 2-oxo monocarboxylic acid (CHEBI:35910)
IUPAC Name 
3-(3-methoxyphenyl)-2-oxopropanoic acid
Manual XrefsDatabases
255955ChemSpider
C91154KEGG COMPOUND