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CHEBI:128669 - (1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-N-propyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:128669
ChEBI Name(1R)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-N-propyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide
Stars
DownloadsMolfile
FormulaC21H30N4O5S
Net Charge0
Average Mass450.561
Monoisotopic Mass450.19369
SMILESCCCNC(=O)N1CC2(C1)CN(S(C)(=O)=O)[C@@H](CO)c1c2c2ccc(OC)cc2n1C
InChIInChI=1S/C21H30N4O5S/c1-5-8-22-20(27)24-11-21(12-24)13-25(31(4,28)29)17(10-26)19-18(21)15-7-6-14(30-3)9-16(15)23(19)2/h6-7,9,17,26H,5,8,10-13H2,1-4H3,(H,22,27)/t17-/m0/s1
InChIKeyJKJZPVKAGMGLTQ-KRWDZBQOSA-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-(hydroxymethyl)-7-methoxy-9-methyl-2-methylsulfonyl-N-propyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:128669) is a harmala alkaloid (CHEBI:61379)
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