N-gamma-Acetyl-N-2-Formyl-5-Methoxykynurenamine (CHEBI:194285)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	N-gamma-Acetyl-N-2-Formyl-5-Methoxykynurenamine

ChEBI ID	CHEBI:194285

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H16N2O4

Net Charge

Average Mass

264.281

Monoisotopic Mass

264.11101

InChI

InChI=1S/C13H16N2O4/c1-9(17)14-6-5-13(18)11-7-10(19-2)3-4-12(11)15-8-16/h3-4,7-8H,5-6H2,1-2H3,(H,14,17)(H,15,16)

InChIKey

JYWNYMJKURVPFH-UHFFFAOYSA-N

SMILES

O(C1=CC(C(=O)CCNC(=O)C)=C(NC=O)C=C1)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in peripheral blood mononuclear cell (BTO:0001025). See: MetaboLights Study

ChEBI Ontology
Outgoing	N-gamma-Acetyl-N-2-Formyl-5-Methoxykynurenamine (CHEBI:194285) is a aromatic ketone (CHEBI:76224)

IUPAC Name

N-[3-(2-ormamido-5-methoxyphenyl)-3-oxopropyl]acetamide