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CHEBI:128955 - [(1R)-7-methoxy-1'-(4-oxanylmethyl)-2-(pyridin-4-ylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol

ChEBI IDCHEBI:128955
ChEBI Name[(1R)-7-methoxy-1'-(4-oxanylmethyl)-2-(pyridin-4-ylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol
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DownloadsMolfile
FormulaC27H34N4O3
Net Charge0
Average Mass462.594
Monoisotopic Mass462.26309
SMILESCOc1ccc2c3c(nc2c1)[C@H](CO)N(Cc1ccncc1)CC31CN(CC2CCOCC2)C1
InChIInChI=1S/C27H34N4O3/c1-33-21-2-3-22-23(12-21)29-26-24(15-32)31(14-19-4-8-28-9-5-19)18-27(25(22)26)16-30(17-27)13-20-6-10-34-11-7-20/h2-5,8-9,12,20,24,29,32H,6-7,10-11,13-18H2,1H3/t24-/m0/s1
InChIKeyQYBIKLKKBUWXNJ-DEOSSOPVSA-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-1'-(4-oxanylmethyl)-2-(pyridin-4-ylmethyl)-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:128955) is a harmala alkaloid (CHEBI:61379)
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