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CHEBI:130520 - [(1R)-1-(hydroxymethyl)-7-methoxy-2-methylsulfonyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-phenylmethanone

ChEBI IDCHEBI:130520
ChEBI Name[(1R)-1-(hydroxymethyl)-7-methoxy-2-methylsulfonyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-phenylmethanone
Stars
DownloadsMolfile
FormulaC25H29N3O5S
Net Charge0
Average Mass483.590
Monoisotopic Mass483.18279
SMILESCOc1ccc2c3c(nc2c1)[C@H](CO)N(S(C)(=O)=O)CC31CCN(C(=O)c2ccccc2)CC1
InChIInChI=1S/C25H29N3O5S/c1-33-18-8-9-19-20(14-18)26-23-21(15-29)28(34(2,31)32)16-25(22(19)23)10-12-27(13-11-25)24(30)17-6-4-3-5-7-17/h3-9,14,21,26,29H,10-13,15-16H2,1-2H3/t21-/m0/s1
InChIKeyAIKZCTQSAVYQKD-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)
[(1R)-1-(hydroxymethyl)-7-methoxy-2-methylsulfonyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-phenylmethanone (CHEBI:130520) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-42069LINCS