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CHEBI:128694 - [(1R)-7-methoxy-2,9-dimethyl-1'-(3-methylphenyl)sulfonyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:128694
ChEBI Name[(1R)-7-methoxy-2,9-dimethyl-1'-(3-methylphenyl)sulfonyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC24H29N3O4S
Net Charge0
Average Mass455.580
Monoisotopic Mass455.18788
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(C)CC31CN(S(=O)(=O)c2cccc(C)c2)C1
InChIInChI=1S/C24H29N3O4S/c1-16-6-5-7-18(10-16)32(29,30)27-14-24(15-27)13-25(2)21(12-28)23-22(24)19-9-8-17(31-4)11-20(19)26(23)3/h5-11,21,28H,12-15H2,1-4H3/t21-/m0/s1
InChIKeyULPICNQPCCMLSF-NRFANRHFSA-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)-7-methoxy-2,9-dimethyl-1'-(3-methylphenyl)sulfonyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:128694) is a harmala alkaloid (CHEBI:61379)
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