CHEBI:129641 - [(1R)-1'-(benzenesulfonyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:129641
ChEBI Name[(1R)-1'-(benzenesulfonyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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FormulaC24H29N3O4S
Net Charge0
Average Mass455.580
Monoisotopic Mass455.18788
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)NCC31CCN(S(=O)(=O)c2ccccc2)CC1
InChIInChI=1S/C24H29N3O4S/c1-26-21-14-17(31-2)8-9-19(21)22-23(26)20(15-28)25-16-24(22)10-12-27(13-11-24)32(29,30)18-6-4-3-5-7-18/h3-9,14,20,25,28H,10-13,15-16H2,1-2H3/t20-/m0/s1
InChIKeyNHMASEOOQBTKMW-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)
[(1R)-1'-(benzenesulfonyl)-7-methoxy-9-methyl-1-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:129641) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-41192LINCS