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CHEBI:140766 - 2-O-acetyl-trans-coutaric acid

ChEBI IDCHEBI:140766
ChEBI Name2-O-acetyl-trans-coutaric acid
Stars
ASCII Name2-O-acetyl-trans-coutaric acid
Last Modified16 May 2018
Submittermwilliams
DownloadsMolfile
FormulaC15H14O9
Net Charge0
Average Mass338.268
Monoisotopic Mass338.06378
SMILESCC(=O)OC(C(=O)O)C(OC(=O)/C=C/c1ccc(O)cc1)C(=O)O
InChIInChI=1S/C15H14O9/c1-8(16)23-12(14(19)20)13(15(21)22)24-11(18)7-4-9-2-5-10(17)6-3-9/h2-7,12-13,17H,1H3,(H,19,20)(H,21,22)/b7-4+
InChIKeyAILCSCQIQZTQJR-QPJJXVBHSA-N
ChEBI Ontology
Outgoing Relation(s)
2-O-acetyl-trans-coutaric acid (CHEBI:140766) is a cinnamate ester (CHEBI:36087)
Manual XrefsDatabases
8557914ChemSpider
HMDB0034621HMDB