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CHEBI:126647 - (1R)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-N-propan-2-yl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide

ChEBI IDCHEBI:126647
ChEBI Name(1R)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-N-propan-2-yl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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DownloadsMolfile
FormulaC27H33ClN4O3
Net Charge0
Average Mass497.039
Monoisotopic Mass496.22412
SMILESCOc1ccc2c3c(n(C)c2c1)[C@H](CO)N(Cc1ccc(Cl)cc1)CC31CN(C(=O)NC(C)C)C1
InChIInChI=1S/C27H33ClN4O3/c1-17(2)29-26(34)32-15-27(16-32)14-31(12-18-5-7-19(28)8-6-18)23(13-33)25-24(27)21-10-9-20(35-4)11-22(21)30(25)3/h5-11,17,23,33H,12-16H2,1-4H3,(H,29,34)/t23-/m0/s1
InChIKeyGOEKWDDDUSGPML-QHCPKHFHSA-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)-2-[(4-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-N-propan-2-yl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:126647) is a harmala alkaloid (CHEBI:61379)
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