(1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:128829)

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CHEBI:128829 - (1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

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ChEBI ID	CHEBI:128829
ChEBI Name	(1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide
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Downloads	Molfile

Formula	C23H24F2N4O3
Net Charge	0
Average Mass	442.466
Monoisotopic Mass	442.18165
SMILES	COc1ccc2c3c(n(C)c2c1)[C@@H](CO)NCC31CN(C(=O)Nc2ccc(F)cc2F)C1
InChI	InChI=1S/C23H24F2N4O3/c1-28-19-8-14(32-2)4-5-15(19)20-21(28)18(9-30)26-10-23(20)11-29(12-23)22(31)27-17-6-3-13(24)7-16(17)25/h3-8,18,26,30H,9-12H2,1-2H3,(H,27,31)/t18-/m1/s1
InChIKey	HYRFXBOBNLPXSI-GOSISDBHSA-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)
	(1S)-N-(2,4-difluorophenyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[2,3-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide (CHEBI:128829) is a harmala alkaloid (CHEBI:61379)

Manual Xrefs	Databases
LSM-40381	LINCS