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CHEBI:212209 - Aspergisocoumrin C

ChEBI IDCHEBI:212209
ChEBI NameAspergisocoumrin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H14O6
Net Charge0
Average Mass278.260
Monoisotopic Mass278.07904
SMILESCOC(=O)CCc1cc2cc(OC)cc(O)c2c(=O)o1
InChIInChI=1S/C14H14O6/c1-18-10-6-8-5-9(3-4-12(16)19-2)20-14(17)13(8)11(15)7-10/h5-7,15H,3-4H2,1-2H3
InChIKeyNDSBJNTWBIHAGI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29594840)
ChEBI Ontology
Outgoing Relation(s)
Aspergisocoumrin C (CHEBI:212209) is a isocoumarins (CHEBI:38758)
IUPAC Name 
methyl 3-(8-hydroxy-6-methoxy-1-oxoisochromen-3-yl)propanoate
Manual XrefsDatabases
73930423ChemSpider