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CHEBI:211083 - Pinophilone B

ChEBI IDCHEBI:211083
ChEBI NamePinophilone B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H18O8
Net Charge0
Average Mass374.345
Monoisotopic Mass374.10017
SMILESCOC(=O)c1cc(OC)cc(OC)c1C(=O)c1coc2c(c1=O)O[C@H](C)C2
InChIInChI=1S/C19H18O8/c1-9-5-14-18(27-9)17(21)12(8-26-14)16(20)15-11(19(22)25-4)6-10(23-2)7-13(15)24-3/h6-9H,5H2,1-4H3/t9-/m1/s1
InChIKeyIUHGCYSFZSKKDN-SECBINFHSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (31128244)
ChEBI Ontology
Outgoing Relation(s)
Pinophilone B (CHEBI:211083) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
methyl 3,5-dimethoxy-2-[(2R)-2-methyl-7-oxo-2,3-dihydrouro[3,2-b]pyran-6-carbonyl]benzoate
Manual XrefsDatabases
76712505ChemSpider