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CHEBI:169698 - Koenimbine

ChEBI IDCHEBI:169698
ChEBI NameKoenimbine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H19NO2
Net Charge0
Average Mass293.366
Monoisotopic Mass293.14158
SMILESCOc1ccc2nc3c4c(c(C)cc3c2c1)OC(C)(C)C=C4
InChIInChI=1S/C19H19NO2/c1-11-9-15-14-10-12(21-4)5-6-16(14)20-17(15)13-7-8-19(2,3)22-18(11)13/h5-10,20H,1-4H3
InChIKeyOSERHKINMDLESD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Koenimbine (CHEBI:169698) is a carbazoles (CHEBI:48513)
IUPAC Name 
8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazole
Manual XrefsDatabases
HMDB0030210HMDB
87989ChemSpider
Registry NumbersSources
CAS:21087-98-9ChemIDplus