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CHEBI:227186 - Peniciherqueinone

ChEBI IDCHEBI:227186
ChEBI NamePeniciherqueinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H20O7
Net Charge0
Average Mass372.373
Monoisotopic Mass372.12090
SMILESCOc1cc2c3c(c1O)C(=O)C(O)=C(C)C3=C1O[C@H](C)C(C)(C)C1(O)C2=O
InChIInChI=1S/C20H20O7/c1-7-11-12-9(6-10(26-5)15(22)13(12)16(23)14(7)21)17(24)20(25)18(11)27-8(2)19(20,3)4/h6,8,21-22,25H,1-5H3/t8-,20?/m1/s1
InChIKeyPQICYTPGRSKLQC-PMLQENADSA-N
Species of MetaboliteComponentSourceComments
Penicillium herquei (ncbitaxon:69774) - PubMed (25079041)
ChEBI Ontology
Outgoing Relation(s)
Peniciherqueinone (CHEBI:227186) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(9R)-2,4,7a-trihydroxy-5-methoxy-1,8,8,9-tetramethyl-9H-phenaleno[3,2-b]uran-3,7-dione
Manual XrefsDatabases
78437825ChemSpider