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CHEBI:223639 - 3-((E)-2-carboxyethenyl)-5-(4-hydroxyphenyl)-4-pyrone-2-carboxylic acid

ChEBI IDCHEBI:223639
ChEBI Name3-((E)-2-carboxyethenyl)-5-(4-hydroxyphenyl)-4-pyrone-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H10O7
Net Charge0
Average Mass302.238
Monoisotopic Mass302.04265
SMILESO=C(O)/C=C/c1c(C(=O)O)occ(-c2ccc(O)cc2)c1=O
InChIInChI=1S/C15H10O7/c16-9-3-1-8(2-4-9)11-7-22-14(15(20)21)10(13(11)19)5-6-12(17)18/h1-7,16H,(H,17,18)(H,20,21)/b6-5+
InChIKeyIMBFSFAPSYRTQN-AATRIKPKSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (15914921)
ChEBI Ontology
Outgoing Relation(s)
3-((E)-2-carboxyethenyl)-5-(4-hydroxyphenyl)-4-pyrone-2-carboxylic acid (CHEBI:223639) is a pyranone (CHEBI:37963)
IUPAC Name 
3-[(E)-2-carboxyethenyl]-5-(4-hydroxyphenyl)-4-oxopyran-2-carboxylic acid
Manual XrefsDatabases
78434919ChemSpider