EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:193479 - N-cis-Caffeoyltyramine

ChEBI IDCHEBI:193479
ChEBI NameN-cis-Caffeoyltyramine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H17NO4
Net Charge0
Average Mass299.326
Monoisotopic Mass299.11576
SMILESO=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccc(O)cc1
InChIInChI=1S/C17H17NO4/c19-14-5-1-12(2-6-14)9-10-18-17(22)8-4-13-3-7-15(20)16(21)11-13/h1-8,11,19-21H,9-10H2,(H,18,22)/b8-4+
InChIKeyVSHUQLRHTJOKTA-XBXARRHUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
N-cis-Caffeoyltyramine (CHEBI:193479) is a catechols (CHEBI:33566)
IUPAC Name 
(E)-3-(3,4-dihydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide
UniProt Name  Source
N-[(E)-caffeoyl]tyramineUniProt
Manual XrefsDatabases
8170478ChemSpider
HMDB0033026HMDB
Registry NumbersSources
CAS:103188-48-3ChemIDplus