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CHEBI:129623 - [(1S)-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1'-methyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:129623
ChEBI Name[(1S)-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1'-methyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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DownloadsMolfile
FormulaC25H31N3O5S
Net Charge0
Average Mass485.606
Monoisotopic Mass485.19844
SMILESCOc1cccc(S(=O)(=O)N2CC3(CCN(C)CC3)c3c(nc4cc(OC)ccc34)[C@H]2CO)c1
InChIInChI=1S/C25H31N3O5S/c1-27-11-9-25(10-12-27)16-28(34(30,31)19-6-4-5-17(13-19)32-2)22(15-29)24-23(25)20-8-7-18(33-3)14-21(20)26-24/h4-8,13-14,22,26,29H,9-12,15-16H2,1-3H3/t22-/m1/s1
InChIKeyYWWSFXVZQIOOMS-JOCHJYFZSA-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)-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1'-methyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:129623) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-41174LINCS