CHEBI:65331 - alkyl caffeate ester

ChEBI IDCHEBI:65331
ChEBI Namealkyl caffeate ester
Stars
DefinitionA cinnamate ester obtained by formal condensation of caffeic acid with any alkyl alcohol.
Last Modified3 December 2019
SubmitterT. Berardini
DownloadsMolfile
FormulaC9H7O4R
Net Charge0
Average Mass (excl. R groups)179.150
Monoisotopic Mass (excl. R groups)179.03443
SMILES*OC(=O)/C=C/c1ccc(O)c(O)c1
ChEBI Ontology
Outgoing Relation(s)
alkyl caffeate ester (CHEBI:65331) has functional parent caffeic acid (CHEBI:36281)
alkyl caffeate ester (CHEBI:65331) is a catechols (CHEBI:33566)
alkyl caffeate ester (CHEBI:65331) is a cinnamate ester (CHEBI:36087)
alkyl caffeate ester (CHEBI:65331) is a phenylpropanoid (CHEBI:26004)
Incoming Relation(s)
(S)-1'-methylbutyl caffeate (CHEBI:70482) is a alkyl caffeate ester (CHEBI:65331)
(S)-1'-methylhexyl caffeate (CHEBI:70483) is a alkyl caffeate ester (CHEBI:65331)
(S)-1'-methyloctyl caffeate (CHEBI:70484) is a alkyl caffeate ester (CHEBI:65331)
(3R,5R)-3,4,5-tris{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1-hydroxycyclohexane-1-carboxylic acid (CHEBI:139424) is a alkyl caffeate ester (CHEBI:65331)
1-O-caffeoylquinic acid (CHEBI:136555) is a alkyl caffeate ester (CHEBI:65331)
1,3-dicaffeoylquinic acid (CHEBI:520) is a alkyl caffeate ester (CHEBI:65331)
ethyl trans-caffeate (CHEBI:132714) is a alkyl caffeate ester (CHEBI:65331)
methyl 3,4-dicaffeoylquinate (CHEBI:85153) is a alkyl caffeate ester (CHEBI:65331)
methyl caffeate (CHEBI:6856) is a alkyl caffeate ester (CHEBI:65331)
monocaffeoylaltraric acid (CHEBI:147327) is a alkyl caffeate ester (CHEBI:65331)
phenethyl caffeate (CHEBI:8062) is a alkyl caffeate ester (CHEBI:65331)
subulatin (CHEBI:66533) is a alkyl caffeate ester (CHEBI:65331)
β-(4-hydroxyphenyl)ethyl-4-O-E-caffeoyl-O-[β-D-apiofuranosyl-(1→2)]-β-D-glucopyranoside (CHEBI:68340) is a alkyl caffeate ester (CHEBI:65331)
Synonym  Source
alkyl caffeateChEBI
Citations