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CHEBI:129196 - [(1S)-1'-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:129196
ChEBI Name[(1S)-1'-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC24H29N3O7S2
Net Charge0
Average Mass535.644
Monoisotopic Mass535.14469
SMILESCCS(=O)(=O)N1CC2(C1)CN(S(=O)(=O)c1cccc(OC)c1)[C@H](CO)c1nc3cc(OC)ccc3c12
InChIInChI=1S/C24H29N3O7S2/c1-4-35(29,30)26-13-24(14-26)15-27(36(31,32)18-7-5-6-16(10-18)33-2)21(12-28)23-22(24)19-9-8-17(34-3)11-20(19)25-23/h5-11,21,25,28H,4,12-15H2,1-3H3/t21-/m1/s1
InChIKeySLWSIWLTTNIUPG-OAQYLSRUSA-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)
[(1S)-1'-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:129196) is a harmala alkaloid (CHEBI:61379)
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