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CHEBI:126362 - cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-methyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanone

ChEBI IDCHEBI:126362
ChEBI Namecyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-methyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanone
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DownloadsMolfile
FormulaC20H25N3O3
Net Charge0
Average Mass355.438
Monoisotopic Mass355.18959
SMILESCOc1ccc2c3c(nc2c1)[C@@H](CO)N(C)CC31CN(C(=O)C2CC2)C1
InChIInChI=1S/C20H25N3O3/c1-22-9-20(10-23(11-20)19(25)12-3-4-12)17-14-6-5-13(26-2)7-15(14)21-18(17)16(22)8-24/h5-7,12,16,21,24H,3-4,8-11H2,1-2H3/t16-/m1/s1
InChIKeyIBTXVFHWOBHAIT-MRXNPFEDSA-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)
cyclopropyl-[(1S)-1-(hydroxymethyl)-7-methoxy-2-methyl-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]yl]methanone (CHEBI:126362) is a harmala alkaloid (CHEBI:61379)
Manual XrefsDatabases
LSM-37927LINCS