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CHEBI:126601 - (1S)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide

ChEBI IDCHEBI:126601
ChEBI Name(1S)-N-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide
Stars
DownloadsMolfile
FormulaC24H27FN4O3
Net Charge0
Average Mass438.503
Monoisotopic Mass438.20672
SMILESCOc1ccc2c3c(nc2c1)[C@@H](CO)NCC31CCN(C(=O)Nc2ccccc2F)CC1
InChIInChI=1S/C24H27FN4O3/c1-32-15-6-7-16-19(12-15)27-22-20(13-30)26-14-24(21(16)22)8-10-29(11-9-24)23(31)28-18-5-3-2-4-17(18)25/h2-7,12,20,26-27,30H,8-11,13-14H2,1H3,(H,28,31)/t20-/m1/s1
InChIKeyOXQZMUJXCMJBAQ-HXUWFJFHSA-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-(2-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide (CHEBI:126601) is a harmala alkaloid (CHEBI:61379)
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