CHEBI:206052 - Asperisocoumarin F

ChEBI IDCHEBI:206052
ChEBI NameAsperisocoumarin F
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SubmitterMetaboLights
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FormulaC22H22O9
Net Charge0
Average Mass430.409
Monoisotopic Mass430.12638
SMILESCOc1cc2c(c(O)c1COCc1c(OC)cc3c(c1O)C(=O)OCC3)C(=O)OCC2
InChIInChI=1S/C22H22O9/c1-27-15-7-11-3-5-30-21(25)17(11)19(23)13(15)9-29-10-14-16(28-2)8-12-4-6-31-22(26)18(12)20(14)24/h7-8,23-24H,3-6,9-10H2,1-2H3
InChIKeyBLQFWMPMIIOMSF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (27829913)
ChEBI Ontology
Outgoing Relation(s)
Asperisocoumarin F (CHEBI:206052) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
8-hydroxy-7-[(8-hydroxy-6-methoxy-1-oxo-3,4-dihydroisochromen-7-yl)methoxymethyl]-6-methoxy-3,4-dihydroisochromen-1-one
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60596816ChemSpider