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CHEBI:69058 - 3-Bromo-N-methyltyramine

ChEBI IDCHEBI:69058
ChEBI Name3-Bromo-N-methyltyramine
Stars
DefinitionA natural product found in Paramuricea clavata.
Last Modified22 September 2014
DownloadsMolfile
FormulaC9H12BrNO
Net Charge0
Average Mass230.105
Monoisotopic Mass229.01023
SMILESCNCCc1ccc(O)c(Br)c1
InChIInChI=1S/C9H12BrNO/c1-11-5-4-7-2-3-9(12)8(10)6-7/h2-3,6,11-12H,4-5H2,1H3
InChIKeyAINJSQXLMHMVIX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Paramuricea clavata (ncbitaxon:317549) - PubMed (21939218) CH2Cl2:MeOH(1:1) extract of lyophilized material
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
3-Bromo-N-methyltyramine (CHEBI:69058) has role metabolite (CHEBI:25212)
3-Bromo-N-methyltyramine (CHEBI:69058) is a primary amine (CHEBI:32877)
Synonym  Source
2-bromo-4-[2-(methylamino)ethyl]phenolChEBI
Citations