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CHEBI:127088 - [(1R)-1'-ethylsulfonyl-7-methoxy-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol

ChEBI IDCHEBI:127088
ChEBI Name[(1R)-1'-ethylsulfonyl-7-methoxy-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol
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DownloadsMolfile
FormulaC19H27N3O4S
Net Charge0
Average Mass393.509
Monoisotopic Mass393.17223
SMILESCCS(=O)(=O)N1CCC2(CC1)CN[C@@H](CO)c1nc3cc(OC)ccc3c12
InChIInChI=1S/C19H27N3O4S/c1-3-27(24,25)22-8-6-19(7-9-22)12-20-16(11-23)18-17(19)14-5-4-13(26-2)10-15(14)21-18/h4-5,10,16,20-21,23H,3,6-9,11-12H2,1-2H3/t16-/m0/s1
InChIKeyFUGMCAUAETXRSX-INIZCTEOSA-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-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]yl]methanol (CHEBI:127088) is a harmala alkaloid (CHEBI:61379)
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