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CHEBI:127542 - 1-[(1R)-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-phenylethanone

ChEBI IDCHEBI:127542
ChEBI Name1-[(1R)-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-phenylethanone
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DownloadsMolfile
FormulaC25H29N3O3
Net Charge0
Average Mass419.525
Monoisotopic Mass419.22089
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(C(=O)Cc1ccccc1)CC31CN(C)C1
InChIInChI=1S/C25H29N3O3/c1-26-14-25(15-26)16-28(22(30)11-17-7-5-4-6-8-17)21(13-29)24-23(25)19-10-9-18(31-3)12-20(19)27(24)2/h4-10,12,21,29H,11,13-16H2,1-3H3/t21-/m0/s1
InChIKeyKLFBAQLYBKDDIQ-NRFANRHFSA-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-[(1R)-1-(hydroxymethyl)-7-methoxy-1',9-dimethyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-phenylethanone (CHEBI:127542) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-39100LINCS