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CHEBI:214840 - (+)-penilactone C

ChEBI IDCHEBI:214840
ChEBI Name(+)-penilactone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O5
Net Charge0
Average Mass276.288
Monoisotopic Mass276.09977
SMILESCC(=O)c1cc(C)c2c(c1O)C[C@H]1CC(=O)O[C@@]1(C)O2
InChIInChI=1S/C15H16O5/c1-7-4-10(8(2)16)13(18)11-5-9-6-12(17)19-15(9,3)20-14(7)11/h4,9,18H,5-6H2,1-3H3/t9-,15-/m0/s1
InChIKeyQLWHUEPJEXNRJI-VFZGTOFNSA-N
Species of MetaboliteComponentSourceComments
Penicillium crustosum (ncbitaxon:36656) - DOI (10.1016/j.phytol.2020.02.008)
ChEBI Ontology
Outgoing Relation(s)
(+)-penilactone C (CHEBI:214840) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
(3aS,9aR)-6-acetyl-5-hydroxy-8,9a-dimethyl-3a,4-dihydro-3H-uro[2,3-b]chromen-2-one