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CHEBI:115621 - 3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid [2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester

ChEBI IDCHEBI:115621
ChEBI Name3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid [2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester
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DownloadsMolfile
FormulaC21H22N2O7
Net Charge0
Average Mass414.414
Monoisotopic Mass414.14270
SMILESCOc1cc(C=CC(=O)OCC(=O)N2CCN(C(=O)c3ccco3)CC2)ccc1O
InChIInChI=1S/C21H22N2O7/c1-28-18-13-15(4-6-16(18)24)5-7-20(26)30-14-19(25)22-8-10-23(11-9-22)21(27)17-3-2-12-29-17/h2-7,12-13,24H,8-11,14H2,1H3
InChIKeyFNACFNWYCZZNOP-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)
3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid [2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester (CHEBI:115621) is a hydroxycinnamic acid (CHEBI:24689)
Manual XrefsDatabases
LSM-27078LINCS