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CHEBI:46371 - uracil-6-ylacetic acid

Default Structure
ChEBI IDCHEBI:46371
ChEBI Nameuracil-6-ylacetic acid
Stars
DefinitionA monocarboxylic acid comprising uracil having a carboxymethyl substituent at the 6-position.
Last Modified18 February 2011
DownloadsMolfile
FormulaC6H6N2O4
Net Charge0
Average Mass170.124
Monoisotopic Mass170.03276
SMILESO=C(O)Cc1cc(=O)nc(=O)n1
InChIInChI=1S/C6H6N2O4/c9-4-1-3(2-5(10)11)7-6(12)8-4/h1H,2H2,(H,10,11)(H2,7,8,9,12)
InChIKeyNQAUNZZEYKWTHM-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)
uracil-6-ylacetic acid (CHEBI:46371) has functional parent acetic acid (CHEBI:15366)
uracil-6-ylacetic acid (CHEBI:46371) has functional parent uracil (CHEBI:17568)
uracil-6-ylacetic acid (CHEBI:46371) is a monocarboxylic acid (CHEBI:25384)
IUPAC Name 
(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)acetic acid
Synonyms  Source
1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidineacetic acidChemIDplus
6-CarboxymethyluracilChemIDplus
Manual XrefsDatabases
DB03048DrugBank
UAAPDBeChem
Registry NumbersSources
Reaxys:150683Reaxys
CAS:4628-39-1ChemIDplus
Citations