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CHEBI:129737 - (1S)-N1'-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-N2-propylspiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1',2-dicarboxamide

ChEBI IDCHEBI:129737
ChEBI Name(1S)-N1'-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-N2-propylspiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1',2-dicarboxamide
Stars
DownloadsMolfile
FormulaC29H36FN5O4
Net Charge0
Average Mass537.636
Monoisotopic Mass537.27513
SMILESCCCNC(=O)N1CC2(CCN(C(=O)Nc3cccc(F)c3)CC2)c2c(n(C)c3cc(OC)ccc23)[C@H]1CO
InChIInChI=1S/C29H36FN5O4/c1-4-12-31-27(37)35-18-29(10-13-34(14-11-29)28(38)32-20-7-5-6-19(30)15-20)25-22-9-8-21(39-3)16-23(22)33(2)26(25)24(35)17-36/h5-9,15-16,24,36H,4,10-14,17-18H2,1-3H3,(H,31,37)(H,32,38)/t24-/m1/s1
InChIKeySVIBUUHZBFMTOL-XMMPIXPASA-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)-N1'-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-N2-propylspiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]-1',2-dicarboxamide (CHEBI:129737) is a harmala alkaloid (CHEBI:61379)
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