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CHEBI:127231 - (1R)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-[2-(4-morpholinyl)-1-oxoethyl]-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide

ChEBI IDCHEBI:127231
ChEBI Name(1R)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-[2-(4-morpholinyl)-1-oxoethyl]-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide
Stars
DownloadsMolfile
FormulaC31H38FN5O5
Net Charge0
Average Mass579.673
Monoisotopic Mass579.28570
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(C(=O)CN1CCOCC1)CC31CCN(C(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C31H38FN5O5/c1-34-25-17-23(41-2)6-7-24(25)28-29(34)26(19-38)37(27(39)18-35-12-14-42-15-13-35)20-31(28)8-10-36(11-9-31)30(40)33-22-5-3-4-21(32)16-22/h3-7,16-17,26,38H,8-15,18-20H2,1-2H3,(H,33,40)/t26-/m0/s1
InChIKeyZPTMAJCPZVQQQA-SANMLTNESA-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)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-[2-(4-morpholinyl)-1-oxoethyl]-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]carboxamide (CHEBI:127231) is a harmala alkaloid (CHEBI:61379)
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