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CHEBI:126185 - (1S)-N-cyclopentyl-2-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:126185
ChEBI Name(1S)-N-cyclopentyl-2-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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DownloadsMolfile
FormulaC25H34N4O3
Net Charge0
Average Mass438.572
Monoisotopic Mass438.26309
SMILESCOc1ccc2c3c(nc2c1)[C@@H](CO)N(CC1CC1)CC31CN(C(=O)NC2CCCC2)C1
InChIInChI=1S/C25H34N4O3/c1-32-18-8-9-19-20(10-18)27-23-21(12-30)28(11-16-6-7-16)13-25(22(19)23)14-29(15-25)24(31)26-17-4-2-3-5-17/h8-10,16-17,21,27,30H,2-7,11-15H2,1H3,(H,26,31)/t21-/m1/s1
InChIKeyYOMIOEXLRSAPBQ-OAQYLSRUSA-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-cyclopentyl-2-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:126185) is a harmala alkaloid (CHEBI:61379)
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