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CHEBI:92188 - 2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid 3-phenylprop-2-enyl ester

ChEBI IDCHEBI:92188
ChEBI Name2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid 3-phenylprop-2-enyl ester
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FormulaC19H15NO4
Net Charge0
Average Mass321.332
Monoisotopic Mass321.10011
SMILESN#CC(=Cc1ccc(O)c(O)c1)C(=O)OCC=Cc1ccccc1
InChIInChI=1S/C19H15NO4/c20-13-16(11-15-8-9-17(21)18(22)12-15)19(23)24-10-4-7-14-5-2-1-3-6-14/h1-9,11-12,21-22H,10H2
InChIKeyXGHYFEJMJXGPGN-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-cyano-3-(3,4-dihydroxyphenyl)-2-propenoic acid 3-phenylprop-2-enyl ester (CHEBI:92188) is a hydroxycinnamic acid (CHEBI:24689)
Manual XrefsDatabases
LSM-2222LINCS