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CHEBI:187519 - YM-53601

ChEBI IDCHEBI:187519
ChEBI NameYM-53601
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H21FN2O.HCl
Net Charge0
Average Mass372.871
Monoisotopic Mass372.14047
SMILESCl.FC(COc1ccc2c(c1)nc1ccccc12)=C1CN2CCC1CC2
InChIInChI=1S/C21H21FN2O.ClH/c22-19(18-12-24-9-7-14(18)8-10-24)13-25-15-5-6-17-16-3-1-2-4-20(16)23-21(17)11-15;/h1-6,11,14,23H,7-10,12-13H2;1H
InChIKeyJWXYVHMBPISIJQ-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)
YM-53601 (CHEBI:187519) is a carbazoles (CHEBI:48513)
IUPAC Name 
2-[2-(1-azabicyclo[2.2.2]octan-3-ylidene)-2-luoroethoxy]-9H-carbazole;hydrochloride
Manual XrefsDatabases
8083184ChemSpider