EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:17253 - 1,2-benzoquinone

ChEBI IDCHEBI:17253
ChEBI Name1,2-benzoquinone
Stars
DefinitionA benzoquinone resulting from the formal oxidation of catechol.
Secondary ChEBI IDsCHEBI:484, CHEBI:11139, CHEBI:18863
Last Modified2 June 2016
DownloadsMolfile
FormulaC6H4O2
Net Charge0
Average Mass108.096
Monoisotopic Mass108.02113
SMILESO=C1C=CC=CC1=O
InChIInChI=1S/C6H4O2/c7-5-3-1-2-4-6(5)8/h1-4H
InChIKeyWOAHJDHKFWSLKE-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
1,2-benzoquinone (CHEBI:17253) is a 1,2-benzoquinones (CHEBI:132123)
1,2-benzoquinone (CHEBI:17253) is a benzoquinone (CHEBI:39439)
Incoming Relation(s)
6-iminocyclohexa-2,4-dienone (CHEBI:55409) has functional parent 1,2-benzoquinone (CHEBI:17253)
dopaminoquinone (CHEBI:74684) has functional parent 1,2-benzoquinone (CHEBI:17253)
IUPAC Name 
cyclohexa-3,5-diene-1,2-dione
Synonyms  Source
1,2-BenzoquinoneKEGG COMPOUND
1,2-BenzoquinoneKEGG COMPOUND
2-benzoquinoneChemIDplus
3,5-cyclohexadiene-1,2-dioneNIST Chemistry WebBook
catechol quinoneChEBI
cyclohexa-3,5-diene-1,2-dioneChEBI
UniProt Name  Source
1,2-benzoquinoneUniProt
Manual XrefsDatabases
1,2-BenzoquinoneWikipedia
C02351KEGG COMPOUND
Registry NumbersSources
Beilstein:2038185Beilstein
Gmelin:26767Gmelin
CAS:583-63-1ChemIDplus
CAS:583-63-1NIST Chemistry WebBook
CAS:583-63-1KEGG COMPOUND