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CHEBI:130512 - [(1R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1'-(4-oxanylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:130512
ChEBI Name[(1R)-7-methoxy-2-[(3-methoxyphenyl)methyl]-1'-(4-oxanylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC29H37N3O4
Net Charge0
Average Mass491.632
Monoisotopic Mass491.27841
SMILESCOc1cccc(CN2CC3(CN(CC4CCOCC4)C3)c3c(nc4cc(OC)ccc34)[C@@H]2CO)c1
InChIInChI=1S/C29H37N3O4/c1-34-22-5-3-4-21(12-22)15-32-19-29(17-31(18-29)14-20-8-10-36-11-9-20)27-24-7-6-23(35-2)13-25(24)30-28(27)26(32)16-33/h3-7,12-13,20,26,30,33H,8-11,14-19H2,1-2H3/t26-/m0/s1
InChIKeyBOYAXGSYXWVDBH-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'-(4-oxanylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:130512) is a harmala alkaloid (CHEBI:61379)
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