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CHEBI:127002 - [(1R)-1'-(3-fluorophenyl)sulfonyl-7-methoxy-2,9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:127002
ChEBI Name[(1R)-1'-(3-fluorophenyl)sulfonyl-7-methoxy-2,9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
Stars
DownloadsMolfile
FormulaC25H30FN3O4S
Net Charge0
Average Mass487.597
Monoisotopic Mass487.19411
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(C)CC31CCN(S(=O)(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C25H30FN3O4S/c1-27-16-25(9-11-29(12-10-25)34(31,32)19-6-4-5-17(26)13-19)23-20-8-7-18(33-3)14-21(20)28(2)24(23)22(27)15-30/h4-8,13-14,22,30H,9-12,15-16H2,1-3H3/t22-/m0/s1
InChIKeyKJPRTYBTAUPMGF-QFIPXVFZSA-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'-(3-fluorophenyl)sulfonyl-7-methoxy-2,9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:127002) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
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