CHEBI:17435 - naphthalene-1,2-diol

ChEBI IDCHEBI:17435
ChEBI Namenaphthalene-1,2-diol
Stars
Secondary ChEBI IDsCHEBI:7473, CHEBI:14639, CHEBI:18895, CHEBI:49554
Last Modified27 January 2016
DownloadsMolfile
FormulaC10H8O2
Net Charge0
Average Mass160.172
Monoisotopic Mass160.05243
SMILESOc1ccc2ccccc2c1O
InChIInChI=1S/C10H8O2/c11-9-6-5-7-3-1-2-4-8(7)10(9)12/h1-6,11-12H
InChIKeyNXPPAOGUKPJVDI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
naphthalene-1,2-diol (CHEBI:17435) has role mouse metabolite (CHEBI:75771)
naphthalene-1,2-diol (CHEBI:17435) is a naphthalenediol (CHEBI:38133)
Incoming Relation(s)
1,2-dihydronaphthalene-1,2-diol (CHEBI:28516) has functional parent naphthalene-1,2-diol (CHEBI:17435)
1,2-dihydroxynaphthalene-6-sulfonate (CHEBI:18896) has functional parent naphthalene-1,2-diol (CHEBI:17435)
6-amino-1,2-dihydroxynaphthalene (CHEBI:20697) has functional parent naphthalene-1,2-diol (CHEBI:17435)
8-methylnaphthalene-1,2-diol (CHEBI:38136) has functional parent naphthalene-1,2-diol (CHEBI:17435)
IUPAC Name 
naphthalene-1,2-diol
Synonyms  Source
Naphthalene-1,2-diolKEGG COMPOUND
1,2-NaphthalenediolKEGG COMPOUND
beta-NaphthohydroquinoneKEGG COMPOUND
1,2-DihydroxynaphthaleneKEGG COMPOUND
β-naphthohydroquinoneUM-BBD
1,2-naphthohydroquinoneChEBI
UniProt Name  Source
naphthalene-1,2-diolUniProt
Manual XrefsDatabases
C03012KEGG COMPOUND
C03012KEGG COMPOUND
c0129UM-BBD
DB07610DrugBank
Registry NumbersSources
Beilstein:1908498Beilstein
Gmelin:241000Gmelin
CAS:574-00-5KEGG COMPOUND
CAS:574-00-5ChemIDplus
CAS:574-00-5NIST Chemistry WebBook