CHEBI:89641 - 4-methoxytyramine

ChEBI IDCHEBI:89641
ChEBI Name4-methoxytyramine
Stars
DefinitionA monomethoxybenzene that is dopamine in which the hydroxy group at position 4 is replaced by a methoxy group.
Last Modified25 August 2022
DownloadsMolfile
FormulaC9H13NO2
Net Charge0
Average Mass167.208
Monoisotopic Mass167.09463
SMILESCOc1ccc(CCN)cc1O
InChIInChI=1S/C9H13NO2/c1-12-9-3-2-7(4-5-10)6-8(9)11/h2-3,6,11H,4-5,10H2,1H3
InChIKeyWJXQFVMTIGJBFX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) PubMed (6518609)
Rattus norvegicus (ncbitaxon:10116) Urine (NCIT:C13283) PubMed (404066)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
ChEBI Ontology
Outgoing Relation(s)
4-methoxytyramine (CHEBI:89641) has functional parent dopamine (CHEBI:18243)
4-methoxytyramine (CHEBI:89641) has role human metabolite (CHEBI:77746)
4-methoxytyramine (CHEBI:89641) has role rat metabolite (CHEBI:86264)
4-methoxytyramine (CHEBI:89641) is a monomethoxybenzene (CHEBI:25235)
4-methoxytyramine (CHEBI:89641) is a phenols (CHEBI:33853)
4-methoxytyramine (CHEBI:89641) is a phenylethylamine (CHEBI:50048)
4-methoxytyramine (CHEBI:89641) is a primary amino compound (CHEBI:50994)
4-methoxytyramine (CHEBI:89641) is conjugate base of 4-methoxytyraminium (CHEBI:192993)
Incoming Relation(s)
4-methoxytyraminium (CHEBI:192993) is conjugate acid of 4-methoxytyramine (CHEBI:89641)
IUPAC Name 
5-(2-aminoethyl)-2-methoxyphenol
Synonyms  Source
4-methoxy-3-hydroxyphenethylamineChEBI
4-O-methyldopamineHMDB
3-hydroxy-4-methoxyphenethylamineChemIDplus
5-hydroxy-4-methoxy-benzeneethanamineHMDB
2-(3-hydroxy-4-methoxyphenyl)ethylamineChEBI
4-methoxy-m-tyramineChEBI
Manual XrefsDatabases
HMDB0012162HMDB
FDB028818FooDB
Registry NumbersSources
CAS:3213-30-7ChemIDplus
Citations