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CHEBI:128986 - [(1S)-1'-[(2-chlorophenyl)methyl]-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:128986
ChEBI Name[(1S)-1'-[(2-chlorophenyl)methyl]-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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DownloadsMolfile
FormulaC25H30ClN3O2
Net Charge0
Average Mass439.987
Monoisotopic Mass439.20265
SMILESCOc1ccc2c3c(n(C)c2c1)[C@@H](CO)NCC31CCN(Cc2ccccc2Cl)CC1
InChIInChI=1S/C25H30ClN3O2/c1-28-22-13-18(31-2)7-8-19(22)23-24(28)21(15-30)27-16-25(23)9-11-29(12-10-25)14-17-5-3-4-6-20(17)26/h3-8,13,21,27,30H,9-12,14-16H2,1-2H3/t21-/m1/s1
InChIKeyYFIUIDDMASQDMF-OAQYLSRUSA-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)
[(1S)-1'-[(2-chlorophenyl)methyl]-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:128986) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-40538LINCS