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CHEBI:128485 - [(1R)-1'-ethylsulfonyl-2-[(2-fluorophenyl)methyl]-7-methoxy-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:128485
ChEBI Name[(1R)-1'-ethylsulfonyl-2-[(2-fluorophenyl)methyl]-7-methoxy-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC24H28FN3O4S
Net Charge0
Average Mass473.570
Monoisotopic Mass473.17846
SMILESCCS(=O)(=O)N1CC2(CN(Cc3ccccc3F)[C@@H](CO)c3nc4cc(OC)ccc4c32)C1
InChIInChI=1S/C24H28FN3O4S/c1-3-33(30,31)28-14-24(15-28)13-27(11-16-6-4-5-7-19(16)25)21(12-29)23-22(24)18-9-8-17(32-2)10-20(18)26-23/h4-10,21,26,29H,3,11-15H2,1-2H3/t21-/m0/s1
InChIKeyHAGSOQVDWJKDRG-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'-ethylsulfonyl-2-[(2-fluorophenyl)methyl]-7-methoxy-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:128485) is a harmala alkaloid (CHEBI:61379)
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