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CHEBI:31104 - 3,5-dihydroxyphenylglyoxylic acid

ChEBI IDCHEBI:31104
ChEBI Name3,5-dihydroxyphenylglyoxylic acid
Stars
DefinitionA 2-oxo monocarboxylic acid that is glyoxylic acid in which the aldehyde hydrogen is substituted by a 3,5-dihydroxyphenyl group.
Secondary ChEBI IDCHEBI:75403
Last Modified30 August 2013
SubmitterSteve
DownloadsMolfile
FormulaC8H6O5
Net Charge0
Average Mass182.131
Monoisotopic Mass182.02152
SMILESO=C(O)C(=O)c1cc(O)cc(O)c1
InChIInChI=1S/C8H6O5/c9-5-1-4(2-6(10)3-5)7(11)8(12)13/h1-3,9-10H,(H,12,13)
InChIKeyIXVSXZQERGYQTA-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)
3,5-dihydroxyphenylglyoxylic acid (CHEBI:31104) has functional parent glyoxylic acid (CHEBI:16891)
3,5-dihydroxyphenylglyoxylic acid (CHEBI:31104) is a 2-oxo monocarboxylic acid (CHEBI:35910)
3,5-dihydroxyphenylglyoxylic acid (CHEBI:31104) is a resorcinols (CHEBI:33572)
IUPAC Name 
(3,5-dihydroxyphenyl)(oxo)acetic acid
Manual XrefsDatabases
C12325KEGG COMPOUND
Registry NumbersSources
Reaxys:8905199Reaxys