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CHEBI:229728 - 3,4-dimethoxy-(E)-cinnamate

ChEBI IDCHEBI:229728
ChEBI Name3,4-dimethoxy-(E)-cinnamate
Stars
ASCII Name3,4-dimethoxy-(E)-cinnamate
DefinitionA cinnamate that is the conjugate base of 3,4-dimethoxycinnamic acid resulting from the deprotonation of the carboxy group; Major microspecies at pH 7.3.
Last Modified12 April 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC11H11O4
Net Charge-1
Average Mass207.205
Monoisotopic Mass207.06628
SMILESCOc1ccc(/C=C/C(=O)[O-])cc1OC
InChIInChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/p-1/b6-4+
InChIKeyHJBWJAPEBGSQPR-GQCTYLIASA-M
ChEBI Ontology
Outgoing Relation(s)
3,4-dimethoxy-(E)-cinnamate (CHEBI:229728) is a cinnamates (CHEBI:36091)
3,4-dimethoxy-(E)-cinnamate (CHEBI:229728) is conjugate base of 3,4-dimethoxycinnamic acid (CHEBI:86549)
Incoming Relation(s)
3,4-dimethoxycinnamic acid (CHEBI:86549) is conjugate acid of 3,4-dimethoxy-(E)-cinnamate (CHEBI:229728)
IUPAC Name 
(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate
Synonyms  Source
3,4-dimethoxycinnamateChEBI
(E)-3,4-dimethoxycinnamateChEBI
3-(3,4-dimethoxyphenyl)-(E)-2-propenoateChEBI
3,4-dimethoxy-trans-cinnamateChEBI
(E)-3-(3,4-dimethoxyphenyl)prop-2-enoateChEBI
UniProt Name  Source
3,4-dimethoxy-(E)-cinnamateUniProt
Citations