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CHEBI:127855 - (3-fluorophenyl)-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanone

ChEBI IDCHEBI:127855
ChEBI Name(3-fluorophenyl)-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanone
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DownloadsMolfile
FormulaC25H28FN3O3
Net Charge0
Average Mass437.515
Monoisotopic Mass437.21147
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)NCC31CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C25H28FN3O3/c1-28-21-13-18(32-2)6-7-19(21)22-23(28)20(14-30)27-15-25(22)8-10-29(11-9-25)24(31)16-4-3-5-17(26)12-16/h3-7,12-13,20,27,30H,8-11,14-15H2,1-2H3/t20-/m0/s1
InChIKeyIEQPVKMPJUEQKV-FQEVSTJZSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(3-fluorophenyl)-[(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanone (CHEBI:127855) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
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