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CHEBI:175083 - 4-p-Coumaroyl-1,5-quinolactone

ChEBI IDCHEBI:175083
ChEBI Name4-p-Coumaroyl-1,5-quinolactone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O7
Net Charge0
Average Mass320.297
Monoisotopic Mass320.08960
SMILES[H][C@@]12C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)/C=C/c1ccc(O)cc1)C(=O)O2
InChIInChI=1S/C16H16O7/c17-10-4-1-9(2-5-10)3-6-13(19)23-14-11(18)7-16(21)8-12(14)22-15(16)20/h1-6,11-12,14,17-18,21H,7-8H2/b6-3+/t11-,12-,14-,16+/m1/s1
InChIKeyPZLNXMHSYFPCAE-OTCYKTEZSA-N
ChEBI Ontology
Outgoing Relation(s)
4-p-Coumaroyl-1,5-quinolactone (CHEBI:175083) is a cinnamate ester (CHEBI:36087)
IUPAC Name 
[(1S,3R,4R,5R)-1,3-dihydroxy-7-oxo-6-oxabicyclo[3.2.1]octan-4-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Manual XrefsDatabases
30776764ChemSpider
HMDB0029293HMDB