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CHEBI:126359 - [(1R)-2-(benzenesulfonyl)-1'-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:126359
ChEBI Name[(1R)-2-(benzenesulfonyl)-1'-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
Stars
DownloadsMolfile
FormulaC24H29N3O6S2
Net Charge0
Average Mass519.645
Monoisotopic Mass519.14978
SMILESCCS(=O)(=O)N1CC2(C1)CN(S(=O)(=O)c1ccccc1)[C@@H](CO)c1c2c2ccc(OC)cc2n1C
InChIInChI=1S/C24H29N3O6S2/c1-4-34(29,30)26-14-24(15-26)16-27(35(31,32)18-8-6-5-7-9-18)21(13-28)23-22(24)19-11-10-17(33-3)12-20(19)25(23)2/h5-12,21,28H,4,13-16H2,1-3H3/t21-/m0/s1
InChIKeyAWHIUQLFKYAFAA-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)-2-(benzenesulfonyl)-1'-ethylsulfonyl-7-methoxy-9-methyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:126359) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
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