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CHEBI:186039 - Isoderricin A

ChEBI IDCHEBI:186039
ChEBI NameIsoderricin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H22O3
Net Charge0
Average Mass322.404
Monoisotopic Mass322.15689
SMILESCOc1ccc2c(c1CC=C(C)C)OC(c1ccccc1)CC2=O
InChIInChI=1S/C21H22O3/c1-14(2)9-10-17-19(23-3)12-11-16-18(22)13-20(24-21(16)17)15-7-5-4-6-8-15/h4-9,11-12,20H,10,13H2,1-3H3
InChIKeyVQBWFYNSXWMURP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Isoderricin A (CHEBI:186039) is a flavanones (CHEBI:28863)
IUPAC Name 
7-methoxy-8-(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846217ChemSpider
LMPK12140014LIPID MAPS