EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:186757 - N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxycinnamic acid amide

ChEBI IDCHEBI:186757
ChEBI NameN-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxycinnamic acid amide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H25NO5
Net Charge0
Average Mass371.433
Monoisotopic Mass371.17327
SMILESCOc1ccc(/C=C/C(=O)NCCc2ccc(OC)c(OC)c2)cc1OC
InChIInChI=1S/C21H25NO5/c1-24-17-8-5-15(13-19(17)26-3)7-10-21(23)22-12-11-16-6-9-18(25-2)20(14-16)27-4/h5-10,13-14H,11-12H2,1-4H3,(H,22,23)/b10-7+
InChIKeyOZNUPWACHHUIKC-JXMROGBWSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxycinnamic acid amide (CHEBI:186757) is a cinnamamides (CHEBI:23247)
IUPAC Name 
(E)-3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]prop-2-enamide
Manual XrefsDatabases
HMDB0032226HMDB
894837ChemSpider
Registry NumbersSources
CAS:69444-90-2ChemIDplus