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CHEBI:128324 - 1-[(1R)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-2-cyclopropylethanone

ChEBI IDCHEBI:128324
ChEBI Name1-[(1R)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-2-cyclopropylethanone
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DownloadsMolfile
FormulaC29H33N3O4
Net Charge0
Average Mass487.600
Monoisotopic Mass487.24711
SMILESCOc1ccc2c3c(nc2c1)[C@H](CO)N(C(=O)CC1CC1)CC31CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C29H33N3O4/c1-36-21-9-10-22-23(16-21)30-27-24(17-33)32(25(34)15-19-7-8-19)18-29(26(22)27)11-13-31(14-12-29)28(35)20-5-3-2-4-6-20/h2-6,9-10,16,19,24,30,33H,7-8,11-15,17-18H2,1H3/t24-/m0/s1
InChIKeySWZMFCRECUHGPQ-DEOSSOPVSA-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)
1-[(1R)-1'-benzoyl-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-2-cyclopropylethanone (CHEBI:128324) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-39879LINCS