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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,5-dichloro-2,5-cyclohexadiene-1,4-diol
ChEBI ID CHEBI:28975
Definition A cyclohexadienediol that is cyclohexa-2,5-diene-1,4-diol in which positions 2 and 5 are substituted by chlorines.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:930, CHEBI:19372
Supplier Information
Download Molfile XML SDF
Formula C6H6Cl2O2
Net Charge 0
Average Mass 181.017
Monoisotopic Mass 179.97448
InChI InChI=1S/C6H6Cl2O2/c7-3-1-5(9)4(8)2-6(3)10/h1-2,5-6,9-10H
InChIKey CPXFTNFOQXXRBF-UHFFFAOYSA-N
SMILES C1(=CC(C(=CC1O)Cl)O)Cl
Metabolite of Species Details
Sphingobium japonicum (NCBI:txid452662) of strain UT26S See: PubMed
Roles Classification
Biological Role(s): bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 Sources
1,4-dihydroxyl-2,5-dichloro-2,5-cyclohexadiene ChEBI
2,5-dichloro-2,5-cyclohexadiene-1,4-diol ChEBI
2,5-dichlorocyclohexa-2,5-dien-1,4-diol UniProt
Manual Xrefs Databases
25-DDOL MetaCyc
c0543 UM-BBD
C06599 KEGG COMPOUND
View more database links
Registry Number Type Source
11097793 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
16636477 PubMed citation Europe PMC
17686029 PubMed citation Europe PMC
21389627 PubMed citation Europe PMC
7691794 PubMed citation Europe PMC
Last Modified
28 August 2018