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CHEBI:130397 - [(1R)-7-methoxy-2-[(2-methoxyphenyl)methyl]-1'-(4-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:130397
ChEBI Name[(1R)-7-methoxy-2-[(2-methoxyphenyl)methyl]-1'-(4-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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DownloadsMolfile
FormulaC32H37N3O6S
Net Charge0
Average Mass591.730
Monoisotopic Mass591.24031
SMILESCOc1ccc(S(=O)(=O)N2CCC3(CC2)CN(Cc2ccccc2OC)[C@@H](CO)c2nc4cc(OC)ccc4c23)cc1
InChIInChI=1S/C32H37N3O6S/c1-39-23-8-11-25(12-9-23)42(37,38)35-16-14-32(15-17-35)21-34(19-22-6-4-5-7-29(22)41-3)28(20-36)31-30(32)26-13-10-24(40-2)18-27(26)33-31/h4-13,18,28,33,36H,14-17,19-21H2,1-3H3/t28-/m0/s1
InChIKeyGLVBIXWSAPOEAD-NDEPHWFRSA-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-[(2-methoxyphenyl)methyl]-1'-(4-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:130397) is a harmala alkaloid (CHEBI:61379)
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