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CHEBI:128214 - [(1S)-7-methoxy-1'-thiophen-2-ylsulfonyl-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:128214
ChEBI Name[(1S)-7-methoxy-1'-thiophen-2-ylsulfonyl-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC19H21N3O4S2
Net Charge0
Average Mass419.528
Monoisotopic Mass419.09735
SMILESCOc1ccc2c3c(nc2c1)[C@@H](CO)NCC31CN(S(=O)(=O)c2cccs2)C1
InChIInChI=1S/C19H21N3O4S2/c1-26-12-4-5-13-14(7-12)21-18-15(8-23)20-9-19(17(13)18)10-22(11-19)28(24,25)16-3-2-6-27-16/h2-7,15,20-21,23H,8-11H2,1H3/t15-/m1/s1
InChIKeyZNHZAGOVNITORJ-OAHLLOKOSA-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)-7-methoxy-1'-thiophen-2-ylsulfonyl-1-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:128214) is a harmala alkaloid (CHEBI:61379)
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