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CHEBI:126753 - (1S)-N-cyclohexyl-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide

ChEBI IDCHEBI:126753
ChEBI Name(1S)-N-cyclohexyl-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide
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DownloadsMolfile
FormulaC26H38N4O3
Net Charge0
Average Mass454.615
Monoisotopic Mass454.29439
SMILESCOc1ccc2c3c(n(C)c2c1)[C@@H](CO)N(C(=O)NC1CCCCC1)CC31CCN(C)CC1
InChIInChI=1S/C26H38N4O3/c1-28-13-11-26(12-14-28)17-30(25(32)27-18-7-5-4-6-8-18)22(16-31)24-23(26)20-10-9-19(33-3)15-21(20)29(24)2/h9-10,15,18,22,31H,4-8,11-14,16-17H2,1-3H3,(H,27,32)/t22-/m1/s1
InChIKeyVCUNUYLSVMARMQ-JOCHJYFZSA-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)-N-cyclohexyl-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide (CHEBI:126753) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-38316LINCS