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CHEBI:217100 - Aspergillitine

ChEBI IDCHEBI:217100
ChEBI NameAspergillitine
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H13NO2
Net Charge0
Average Mass239.274
Monoisotopic Mass239.09463
SMILESCc1cc2ccc3c(=O)c(C)c(C)oc3c2cn1
InChIInChI=1S/C15H13NO2/c1-8-6-11-4-5-12-14(17)9(2)10(3)18-15(12)13(11)7-16-8/h4-7H,1-3H3
InChIKeyUCURHOJUSAYQKR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus versicolor (ncbitaxon:46472) - PubMed (12542346)
ChEBI Ontology
Outgoing Relation(s)
Aspergillitine (CHEBI:217100) is a pyridochromene (CHEBI:53792)
IUPAC Name 
2,3,8-trimethylpyrano[3,2-h]isoquinolin-4-one
Manual XrefsDatabases
8167412ChemSpider