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CHEBI:128292 - (1R)-2-(cyclopropylmethyl)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide

ChEBI IDCHEBI:128292
ChEBI Name(1R)-2-(cyclopropylmethyl)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide
Stars
DownloadsMolfile
FormulaC29H34F2N4O3
Net Charge0
Average Mass524.612
Monoisotopic Mass524.25990
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(CC1CC1)CC31CCN(C(=O)Nc2ccc(F)cc2F)CC1
InChIInChI=1S/C29H34F2N4O3/c1-33-24-14-20(38-2)6-7-21(24)26-27(33)25(16-36)35(15-18-3-4-18)17-29(26)9-11-34(12-10-29)28(37)32-23-8-5-19(30)13-22(23)31/h5-8,13-14,18,25,36H,3-4,9-12,15-17H2,1-2H3,(H,32,37)/t25-/m0/s1
InChIKeyPQAHYPXXHOCDLA-VWLOTQADSA-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)-2-(cyclopropylmethyl)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide (CHEBI:128292) is a harmala alkaloid (CHEBI:61379)
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