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CHEBI:128844 - (1R)-1-(hydroxymethyl)-7-methoxy-2-[(3-methoxyphenyl)methyl]-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:128844
ChEBI Name(1R)-1-(hydroxymethyl)-7-methoxy-2-[(3-methoxyphenyl)methyl]-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide
Stars
DownloadsMolfile
FormulaC27H34N4O4
Net Charge0
Average Mass478.593
Monoisotopic Mass478.25801
SMILESCCCNC(=O)N1CC2(C1)CN(Cc1cccc(OC)c1)[C@@H](CO)c1nc3cc(OC)ccc3c12
InChIInChI=1S/C27H34N4O4/c1-4-10-28-26(33)31-16-27(17-31)15-30(13-18-6-5-7-19(11-18)34-2)23(14-32)25-24(27)21-9-8-20(35-3)12-22(21)29-25/h5-9,11-12,23,29,32H,4,10,13-17H2,1-3H3,(H,28,33)/t23-/m0/s1
InChIKeyKZIDXGDKWGRCPF-QHCPKHFHSA-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-[(3-methoxyphenyl)methyl]-N-propyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:128844) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-40396LINCS