CHEBI:129869 - [(1S)-2-[(4-fluorophenyl)methyl]-7-methoxy-1',9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:129869
ChEBI Name[(1S)-2-[(4-fluorophenyl)methyl]-7-methoxy-1',9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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FormulaC26H32FN3O2
Net Charge0
Average Mass437.559
Monoisotopic Mass437.24786
SMILESCOc1ccc2c3c(n(C)c2c1)[C@@H](CO)N(Cc1ccc(F)cc1)CC31CCN(C)CC1
InChIInChI=1S/C26H32FN3O2/c1-28-12-10-26(11-13-28)17-30(15-18-4-6-19(27)7-5-18)23(16-31)25-24(26)21-9-8-20(32-3)14-22(21)29(25)2/h4-9,14,23,31H,10-13,15-17H2,1-3H3/t23-/m1/s1
InChIKeyXUNOMHZPRKPJIF-HSZRJFAPSA-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)-2-[(4-fluorophenyl)methyl]-7-methoxy-1',9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:129869) is a harmala alkaloid (CHEBI:61379)
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LSM-41420LINCS