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CHEBI:127723 - cyclobutyl-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanone

ChEBI IDCHEBI:127723
ChEBI Namecyclobutyl-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanone
Stars
DownloadsMolfile
FormulaC29H41N3O3
Net Charge0
Average Mass479.665
Monoisotopic Mass479.31479
SMILESCOc1ccc2c3c(n(C)c2c1)[C@@H](CO)N(C(=O)C1CCC1)CC31CCN(CC2CCCC2)CC1
InChIInChI=1S/C29H41N3O3/c1-30-24-16-22(35-2)10-11-23(24)26-27(30)25(18-33)32(28(34)21-8-5-9-21)19-29(26)12-14-31(15-13-29)17-20-6-3-4-7-20/h10-11,16,20-21,25,33H,3-9,12-15,17-19H2,1-2H3/t25-/m1/s1
InChIKeyDTSBKGAELJULKZ-RUZDIDTESA-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)
cyclobutyl-[(1S)-1'-(cyclopentylmethyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanone (CHEBI:127723) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
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