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CHEBI:225517 - Penipyranicin A

ChEBI IDCHEBI:225517
ChEBI NamePenipyranicin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H14O5
Net Charge0
Average Mass262.261
Monoisotopic Mass262.08412
SMILESCOc1cc(O)cc(C2=COC(C(=O)O)=C[C@H]2C)c1
InChIInChI=1S/C14H14O5/c1-8-3-13(14(16)17)19-7-12(8)9-4-10(15)6-11(5-9)18-2/h3-8,15H,1-2H3,(H,16,17)/t8-/m1/s1
InChIKeyXWXBFBNYADVVGP-MRVPVSSYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (33296194)
ChEBI Ontology
Outgoing Relation(s)
Penipyranicin A (CHEBI:225517) is a methoxybenzenes (CHEBI:51683)
Penipyranicin A (CHEBI:225517) is a phenols (CHEBI:33853)
IUPAC Name 
(4R)-5-(3-hydroxy-5-methoxyphenyl)-4-methyl-4H-pyran-2-carboxylic acid