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CHEBI:127097 - [(1R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1'-(2-pyridinylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:127097
ChEBI Name[(1R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1'-(2-pyridinylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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FormulaC29H32N4O3
Net Charge0
Average Mass484.600
Monoisotopic Mass484.24744
SMILESCOc1cccc(CN2CC3(CN(Cc4ccccn4)C3)c3c(nc4cc(OC)ccc34)[C@@H]2CO)c1
InChIInChI=1S/C29H32N4O3/c1-35-22-8-5-6-20(12-22)14-33-19-29(17-32(18-29)15-21-7-3-4-11-30-21)27-24-10-9-23(36-2)13-25(24)31-28(27)26(33)16-34/h3-13,26,31,34H,14-19H2,1-2H3/t26-/m0/s1
InChIKeyMIXUGIDMCUQDBF-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)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1'-(2-pyridinylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:127097) is a harmala alkaloid (CHEBI:61379)
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