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CHEBI:44747 - homogentisic acid

ChEBI IDCHEBI:44747
ChEBI Namehomogentisic acid
Stars
DefinitionA dihydroxyphenylacetic acid having the two hydroxy substituents at the 2- and 5-positions.
Secondary ChEBI IDsCHEBI:5755, CHEBI:44744
Last Modified23 October 2015
DownloadsMolfile

FormulaC8H8O4
Net Charge0
Average Mass168.148
Monoisotopic Mass168.04226
SMILESO=C(O)Cc1cc(O)ccc1O
InChIInChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)
InChIKeyIGMNYECMUMZDDF-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
(2,5-dihydroxyphenyl)acetic acid
Synonyms  Source
Homogentisic acidKEGG COMPOUND
2,5-Dihydroxyphenylacetic acidKEGG COMPOUND
2-(3,6-DIHYDROXYPHENYL)ACETIC ACIDPDBeChem
Manual XrefsDatabases
C00544KEGG COMPOUND
OMDPDBeChem
DB08327DrugBank
Homogentisic_acidWikipedia
HMDB0000130HMDB
C00007309KNApSAcK
Registry NumbersSources
Beilstein:2692860Beilstein
Reaxys:2692860Reaxys
CAS:451-13-8KEGG COMPOUND
CAS:451-13-8ChemIDplus
Citations