EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:182908 - 1-[(2E)-3-(3,4,5-Trimethoxyphenyl)prop-2-enoyl]piperidin-2-one

ChEBI IDCHEBI:182908
ChEBI Name1-[(2E)-3-(3,4,5-Trimethoxyphenyl)prop-2-enoyl]piperidin-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H21NO5
Net Charge0
Average Mass319.357
Monoisotopic Mass319.14197
SMILESCOc1cc(/C=C/C(=O)N2CCCCC2=O)cc(OC)c1OC
InChIInChI=1S/C17H21NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h7-8,10-11H,4-6,9H2,1-3H3/b8-7+
InChIKeyHPXUNEGPCPQBQY-BQYQJAHWSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[(2E)-3-(3,4,5-Trimethoxyphenyl)prop-2-enoyl]piperidin-2-one (CHEBI:182908) has functional parent cinnamic acid (CHEBI:27386)
1-[(2E)-3-(3,4,5-Trimethoxyphenyl)prop-2-enoyl]piperidin-2-one (CHEBI:182908) is a olefinic compound (CHEBI:78840)
IUPAC Name 
1-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperidin-2-one
Manual XrefsDatabases
600430ChemSpider
Registry NumbersSources
CAS:82017-78-5ChemIDplus