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CHEBI:129202 - 1-[(1R)-2-[(3-fluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-methoxyethanone

ChEBI IDCHEBI:129202
ChEBI Name1-[(1R)-2-[(3-fluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-methoxyethanone
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DownloadsMolfile
FormulaC26H30FN3O4
Net Charge0
Average Mass467.541
Monoisotopic Mass467.22203
SMILESCOCC(=O)N1CC2(C1)CN(Cc1cccc(F)c1)[C@@H](CO)c1c2c2ccc(OC)cc2n1C
InChIInChI=1S/C26H30FN3O4/c1-28-21-10-19(34-3)7-8-20(21)24-25(28)22(12-31)29(11-17-5-4-6-18(27)9-17)14-26(24)15-30(16-26)23(32)13-33-2/h4-10,22,31H,11-16H2,1-3H3/t22-/m0/s1
InChIKeyPFBNECICYFISDX-QFIPXVFZSA-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)
1-[(1R)-2-[(3-fluorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]-2-methoxyethanone (CHEBI:129202) is a harmala alkaloid (CHEBI:61379)
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