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CHEBI:212202 - Aspergisocoumrin B

ChEBI IDCHEBI:212202
ChEBI NameAspergisocoumrin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H12O6
Net Charge0
Average Mass276.244
Monoisotopic Mass276.06339
SMILESCOC(=O)/C=C\c1cc2cc(OC)cc(O)c2c(=O)o1
InChIInChI=1S/C14H12O6/c1-18-10-6-8-5-9(3-4-12(16)19-2)20-14(17)13(8)11(15)7-10/h3-7,15H,1-2H3/b4-3-
InChIKeyGAMOYIMNWMTRPU-ARJAWSKDSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29594840)
ChEBI Ontology
Outgoing Relation(s)
Aspergisocoumrin B (CHEBI:212202) is a isocoumarins (CHEBI:38758)
IUPAC Name 
methyl (Z)-3-(8-hydroxy-6-methoxy-1-oxoisochromen-3-yl)prop-2-enoate
Manual XrefsDatabases
73930422ChemSpider