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CHEBI:127772 - 1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]ethanone

ChEBI IDCHEBI:127772
ChEBI Name1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]ethanone
Stars
DownloadsMolfile
FormulaC18H23N3O3
Net Charge0
Average Mass329.400
Monoisotopic Mass329.17394
SMILESCOc1ccc2c3c(n(C)c2c1)[C@@H](CO)NCC31CN(C(C)=O)C1
InChIInChI=1S/C18H23N3O3/c1-11(23)21-9-18(10-21)8-19-14(7-22)17-16(18)13-5-4-12(24-3)6-15(13)20(17)2/h4-6,14,19,22H,7-10H2,1-3H3/t14-/m1/s1
InChIKeyXQEZAXSDPOOUCN-CQSZACIVSA-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)
1-[(1S)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]ethanone (CHEBI:127772) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-39329LINCS