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CHEBI:129013 - (1R)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-(2-pyridinylmethyl)-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:129013
ChEBI Name(1R)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-(2-pyridinylmethyl)-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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DownloadsMolfile
FormulaC29H30FN5O3
Net Charge0
Average Mass515.589
Monoisotopic Mass515.23327
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(C(=O)Nc1ccc(F)cc1)CC31CN(Cc2ccccn2)C1
InChIInChI=1S/C29H30FN5O3/c1-33-24-13-22(38-2)10-11-23(24)26-27(33)25(15-36)35(28(37)32-20-8-6-19(30)7-9-20)18-29(26)16-34(17-29)14-21-5-3-4-12-31-21/h3-13,25,36H,14-18H2,1-2H3,(H,32,37)/t25-/m0/s1
InChIKeyFBBSFHIVEPJTOP-VWLOTQADSA-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-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-(2-pyridinylmethyl)-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:129013) is a harmala alkaloid (CHEBI:61379)
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