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CHEBI:27381 - 2,2',3-trihydroxydiphenyl ether

ChEBI IDCHEBI:27381
ChEBI Name2,2',3-trihydroxydiphenyl ether
Stars
DefinitionDiphenyl ether in which the hydrogens at the 2, 3, and 2' positions are substituted by hydroxy groups.
Secondary ChEBI IDsCHEBI:853, CHEBI:19277
Last Modified27 January 2016
DownloadsMolfile
FormulaC12H10O4
Net Charge0
Average Mass218.208
Monoisotopic Mass218.05791
SMILESOc1ccccc1Oc1cccc(O)c1O
InChIInChI=1S/C12H10O4/c13-8-4-1-2-6-10(8)16-11-7-3-5-9(14)12(11)15/h1-7,13-15H
InChIKeyXEAZDMSYJLCYDK-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)
2,2',3-trihydroxydiphenyl ether (CHEBI:27381) has role mouse metabolite (CHEBI:75771)
2,2',3-trihydroxydiphenyl ether (CHEBI:27381) is a aromatic ether (CHEBI:35618)
2,2',3-trihydroxydiphenyl ether (CHEBI:27381) is a catechols (CHEBI:33566)
2,2',3-trihydroxydiphenyl ether (CHEBI:27381) is a phenols (CHEBI:33853)
2,2',3-trihydroxydiphenyl ether (CHEBI:27381) is conjugate acid of 2,2',3-trihydroxydiphenyl ether(2−) (CHEBI:79174)
Incoming Relation(s)
2,2',3-trihydroxydiphenyl ether(2−) (CHEBI:79174) is conjugate base of 2,2',3-trihydroxydiphenyl ether (CHEBI:27381)
IUPAC Name 
3-(2-hydroxyphenoxy)benzene-1,2-diol
Synonyms  Source
2,2',3-TrihydroxydiphenyletherKEGG COMPOUND
2,3,2'-trihydroxydiphenyl etherChEBI
3-(2-hydroxyphenoxy)catecholChEBI
Manual XrefsDatabases
C07733KEGG COMPOUND
c0429UM-BBD
Registry NumbersSources
Beilstein:11058912Beilstein
CAS:128292-53-5ChemIDplus