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CHEBI:177415 - fluspiperone

ChEBI IDCHEBI:177415
ChEBI Namefluspiperone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H25F2N3O2
Net Charge0
Average Mass413.468
Monoisotopic Mass413.19148
SMILESO=C(CCCN1CCC2(CC1)C(=O)NCN2c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C23H25F2N3O2/c24-18-5-3-17(4-6-18)21(29)2-1-13-27-14-11-23(12-15-27)22(30)26-16-28(23)20-9-7-19(25)8-10-20/h3-10H,1-2,11-16H2,(H,26,30)
InChIKeyRIOZXKPJYKSKJV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
ChEBI Ontology
Outgoing Relation(s)
fluspiperone (CHEBI:177415) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
1-(4-luorophenyl)-8-[4-(4-luorophenyl)-4-oxobutyl]-1,3,8-triazaspiro[4.5]decan-4-one
Manual XrefsDatabases
D02661KEGG DRUG
145743ChemSpider
Registry NumbersSources
CAS:54965-22-9ChemIDplus