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CHEBI:225115 - (+/-)-peniphenone E

ChEBI IDCHEBI:225115
ChEBI Name(+/-)-peniphenone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O8
Net Charge0
Average Mass336.296
Monoisotopic Mass336.08452
SMILESCC(=O)c1cc(C)c(O)c(CC2=C(O)[C@H](CC(=O)O)OC2=O)c1O
InChIInChI=1S/C16H16O8/c1-6-3-8(7(2)17)14(21)9(13(6)20)4-10-15(22)11(5-12(18)19)24-16(10)23/h3,11,20-22H,4-5H2,1-2H3,(H,18,19)/t11-/m0/s1
InChIKeyUUIXAUNVUMHZTJ-NSHDSACASA-N
Species of MetaboliteComponentSourceComments
Marquandomyces marquandii (ncbitaxon:64636) - PubMed (31432669)
ChEBI Ontology
Outgoing Relation(s)
(+/-)-peniphenone E (CHEBI:225115) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
2-[4-[(3-acetyl-2,6-dihydroxy-5-methylphenyl)methyl]-3-hydroxy-5-oxo-2H-uran-2-yl]acetic acid
Manual XrefsDatabases
23550470ChemSpider