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CHEBI:141700 - 3-methoxycatechol

ChEBI IDCHEBI:141700
ChEBI Name3-methoxycatechol
Stars
DefinitionA member of the class of catechols that is catechol in which a hydrogen that is ortho to one of the hydroxy groups has been replaced by a methoxy group. It displays agonistic activity against G protein-coupled receptor 35 (GPR35).
Last Modified21 August 2018
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H8O3
Net Charge0
Average Mass140.138
Monoisotopic Mass140.04734
SMILESCOc1cccc(O)c1O
InChIInChI=1S/C7H8O3/c1-10-6-4-2-3-5(8)7(6)9/h2-4,8-9H,1H3
InChIKeyLPYUENQFPVNPHY-UHFFFAOYSA-N
Roles Classification
Biological Role:
G-protein-coupled receptor agonist  An agonist that binds to and activates G-protein-coupled receptors
ChEBI Ontology
Outgoing Relation(s)
3-methoxycatechol (CHEBI:141700) has functional parent pyrogallol (CHEBI:16164)
3-methoxycatechol (CHEBI:141700) has role G-protein-coupled receptor agonist (CHEBI:70998)
3-methoxycatechol (CHEBI:141700) is a aromatic ether (CHEBI:35618)
3-methoxycatechol (CHEBI:141700) is a catechols (CHEBI:33566)
IUPAC Name 
3-methoxybenzene-1,2-diol
Synonyms  Source
1,2-dihydroxy-3-methoxybenzeneChemIDplus
2,3-dihydroxyanisoleChemIDplus
3-methoxypyrocatecholChemIDplus
3-methoxy-o-hydroquinoneNIST Chemistry WebBook
pyrogallol 1-monomethyl etherNIST Chemistry WebBook
pyrogallol 1-methyl etherNIST Chemistry WebBook
UniProt Name  Source
3-methoxycatecholUniProt
Manual XrefsDatabases
HMDB0125538HMDB
Registry NumbersSources
Reaxys:1909165Reaxys
CAS:934-00-9ChemIDplus
CAS:934-00-9NIST Chemistry WebBook
Citations