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CHEBI:129138 - (1R)-1-(hydroxymethyl)-7-methoxy-2-(1-oxobutyl)-N-propan-2-yl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:129138
ChEBI Name(1R)-1-(hydroxymethyl)-7-methoxy-2-(1-oxobutyl)-N-propan-2-yl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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FormulaC23H32N4O4
Net Charge0
Average Mass428.533
Monoisotopic Mass428.24236
SMILESCCCC(=O)N1CC2(CN(C(=O)NC(C)C)C2)c2c(nc3cc(OC)ccc23)[C@@H]1CO
InChIInChI=1S/C23H32N4O4/c1-5-6-19(29)27-13-23(11-26(12-23)22(30)24-14(2)3)20-16-8-7-15(31-4)9-17(16)25-21(20)18(27)10-28/h7-9,14,18,25,28H,5-6,10-13H2,1-4H3,(H,24,30)/t18-/m0/s1
InChIKeyQJIONCXBIFUOGD-SFHVURJKSA-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)-1-(hydroxymethyl)-7-methoxy-2-(1-oxobutyl)-N-propan-2-yl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:129138) is a harmala alkaloid (CHEBI:61379)
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