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CHEBI:28975 - 2,5-dichloro-2,5-cyclohexadiene-1,4-diol

ChEBI IDCHEBI:28975
ChEBI Name2,5-dichloro-2,5-cyclohexadiene-1,4-diol
Stars
DefinitionA cyclohexadienediol that is cyclohexa-2,5-diene-1,4-diol in which positions 2 and 5 are substituted by chlorines.
Secondary ChEBI IDsCHEBI:930, CHEBI:19372
Last Modified28 August 2018
DownloadsMolfile
FormulaC6H6Cl2O2
Net Charge0
Average Mass181.018
Monoisotopic Mass179.97448
SMILESOC1C=C(Cl)C(O)C=C1Cl
InChIInChI=1S/C6H6Cl2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,5-6,9-10H
InChIKeyCPXFTNFOQXXRBF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sphingobium japonicum (ncbitaxon:452662) - PubMed (16636477) Strain: UT26S
Roles Classification
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2,5-dichloro-2,5-cyclohexadiene-1,4-diol (CHEBI:28975) has role bacterial xenobiotic metabolite (CHEBI:76976)
2,5-dichloro-2,5-cyclohexadiene-1,4-diol (CHEBI:28975) is a cyclohexadienediol (CHEBI:23469)
2,5-dichloro-2,5-cyclohexadiene-1,4-diol (CHEBI:28975) is a organic hydroxy compound (CHEBI:33822)
2,5-dichloro-2,5-cyclohexadiene-1,4-diol (CHEBI:28975) is a organochlorine compound (CHEBI:36683)
IUPAC Name 
2,5-dichlorocyclohexa-2,5-diene-1,4-diol
Synonyms  Source
2,5-dichloro-2,5-cyclohexadiene-1,4-diolChEBI
1,4-dihydroxyl-2,5-dichloro-2,5-cyclohexadieneChEBI
UniProt Name  Source
2,5-dichlorocyclohexa-2,5-dien-1,4-diolUniProt
Manual XrefsDatabases
C06599KEGG COMPOUND
c0543UM-BBD
25-DDOLMetaCyc
Registry NumbersSources
Reaxys:11097793Reaxys
Citations