Terminology Service for NFDI4Health
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4-(2-carboxyphenyl)-2-oxobut-3-enoic acid

Go to external page http://purl.obolibrary.org/obo/CHEBI_49223

Term info

Label

4-(2-carboxyphenyl)-2-oxobut-3-enoic acid

Synonyms
  • 2-(3-carboxy-3-oxoprop-1-en-1-yl)benzoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
2-(3-carboxy-3-oxoprop-1-en-1-yl)benzoic acid [ IUPAC ]

charge

0

formula

C11H8O5

has obo namespace

chebi_ontology

has related synonym

2-Cbap, 2'-Carboxybenzalpyruvate

id

CHEBI:49223

inchi

InChI=1S/C11H8O5/c12-9(11(15)16)6-5-7-3-1-2-4-8(7)10(13)14/h1-6H,(H,13,14)(H,15,16)

inchikey

APKXMKWCGDBYNV-UHFFFAOYSA-N

mass

220.17822

monoisotopicmass

220.03717

smiles

[H]C(=Cc1ccccc1C(O)=O)C(=O)C(O)=O