CHEBI:34048 - 1,2-dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,2-dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene
ChEBI ID CHEBI:34048
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C10H10O3
Net Charge 0
Average Mass 178.18460
Monoisotopic Mass 178.06299
InChI InChI=1S/C10H10O3/c11-7-5-3-1-2-4-6(5)9-10(13-9)8(7)12/h1-4,7-12H
InChIKey XDSJRQRRQDAPNL-UHFFFAOYSA-N
SMILES OC1C(O)c2ccccc2C2OC12
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1,2-dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene (CHEBI:34048) has role mouse metabolite (CHEBI:75771)
1,2-dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene (CHEBI:34048) is a epoxide (CHEBI:32955)
1,2-dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene (CHEBI:34048) is a tetralins (CHEBI:36786)
IUPAC Name
1a,2,3,7b-tetrahydronaphtho[1,2-b]oxirene-2,3-diol
Synonym Source
1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene KEGG COMPOUND
Manual Xref Database
C14784 KEGG COMPOUND
View more database links
Registry Number Type Source
75947-54-5 CAS Registry Number ChemIDplus
Last Modified
27 January 2016