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CHEBI:73346 - trans-coumaryl acetate

ChEBI IDCHEBI:73346
ChEBI Nametrans-coumaryl acetate
Stars
ASCII Nametrans-coumaryl acetate
DefinitionA phenylpropanoid that is trans-p-coumaryl alcohol in which the hydrogen from the allylic hydroxy group is replaced by an acetyl group.
Last Modified9 December 2022
SubmitterKAX
DownloadsMolfile
FormulaC11H12O3
Net Charge0
Average Mass192.214
Monoisotopic Mass192.07864
SMILESCC(=O)OC/C=C/c1ccc(O)cc1
InChIInChI=1S/C11H12O3/c1-9(12)14-8-2-3-10-4-6-11(13)7-5-10/h2-7,13H,8H2,1H3/b3-2+
InChIKeyUUEPXFWSBUIUAZ-NSCUHMNNSA-N
ChEBI Ontology
Outgoing Relation(s)
trans-coumaryl acetate (CHEBI:73346) has functional parent trans-p-coumaryl alcohol (CHEBI:64555)
trans-coumaryl acetate (CHEBI:73346) is a acetate ester (CHEBI:47622)
trans-coumaryl acetate (CHEBI:73346) is a phenols (CHEBI:33853)
trans-coumaryl acetate (CHEBI:73346) is a phenylpropanoid (CHEBI:26004)
Synonyms  Source
(2E)-3-(4-hydroxyphenyl)prop-2-en-1-yl acetateChEBI
trans-p-hydroxycinnamyl acetateChEBI
UniProt Name  Source
(E)-coumaryl acetateUniProt
Manual XrefsDatabases
C20465KEGG COMPOUND
CPD-12215MetaCyc
Registry NumbersSources
Reaxys:9479644Reaxys
Citations