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CHEBI:200578 - (-)-peniphenone A

ChEBI IDCHEBI:200578
ChEBI Name(-)-peniphenone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H24O5
Net Charge0
Average Mass332.396
Monoisotopic Mass332.16237
SMILESCC(=O)c1cc(C)c2c(c1O)C[C@@H](C)[C@]1(O2)O[C@H](C)CC(=O)[C@H]1C
InChIInChI=1S/C19H24O5/c1-9-6-14(13(5)20)17(22)15-7-10(2)19(24-18(9)15)12(4)16(21)8-11(3)23-19/h6,10-12,22H,7-8H2,1-5H3/t10-,11-,12-,19-/m1/s1
InChIKeyMPAXYIAYBXQBDW-KIKHTIOSSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (24597756)
ChEBI Ontology
Outgoing Relation(s)
(-)-peniphenone A (CHEBI:200578) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(2R,3R,3'R,6'R)-6-acetyl-5-hydroxy-3,3',6',8-tetramethylspiro[3,4-dihydrochromene-2,2'-oxane]-4'-one
Manual XrefsDatabases
32674720ChemSpider