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CHEBI:125757 - [(1R)-1'-ethylsulfonyl-7-methoxy-9-methyl-2-(4-oxanylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:125757
ChEBI Name[(1R)-1'-ethylsulfonyl-7-methoxy-9-methyl-2-(4-oxanylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
Stars
DownloadsMolfile
FormulaC24H35N3O5S
Net Charge0
Average Mass477.627
Monoisotopic Mass477.22974
SMILESCCS(=O)(=O)N1CC2(CN(CC3CCOCC3)[C@@H](CO)c3c2c2ccc(OC)cc2n3C)C1
InChIInChI=1S/C24H35N3O5S/c1-4-33(29,30)27-15-24(16-27)14-26(12-17-7-9-32-10-8-17)21(13-28)23-22(24)19-6-5-18(31-3)11-20(19)25(23)2/h5-6,11,17,21,28H,4,7-10,12-16H2,1-3H3/t21-/m0/s1
InChIKeyOFAKGSYCSOXBPH-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-7-methoxy-9-methyl-2-(4-oxanylmethyl)-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:125757) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-37326LINCS