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CHEBI:127483 - (1S)-2-benzoyl-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:127483
ChEBI Name(1S)-2-benzoyl-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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DownloadsMolfile
FormulaC26H30N4O4
Net Charge0
Average Mass462.550
Monoisotopic Mass462.22671
SMILESCCCNC(=O)N1CC2(C1)CN(C(=O)c1ccccc1)[C@H](CO)c1nc3cc(OC)ccc3c12
InChIInChI=1S/C26H30N4O4/c1-3-11-27-25(33)29-14-26(15-29)16-30(24(32)17-7-5-4-6-8-17)21(13-31)23-22(26)19-10-9-18(34-2)12-20(19)28-23/h4-10,12,21,28,31H,3,11,13-16H2,1-2H3,(H,27,33)/t21-/m1/s1
InChIKeyBMCDYGKMUWCUEK-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)-2-benzoyl-1-(hydroxymethyl)-7-methoxy-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:127483) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
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