N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)propanimidic acid (CHEBI:186625)

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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-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)propanimidic acid

ChEBI ID	CHEBI:186625

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H22N2O3

Net Charge

Average Mass

266.341

Monoisotopic Mass

266.16304

InChI

InChI=1S/C14H22N2O3/c1-19-13-10-11(4-6-12(13)17)5-7-14(18)16-9-3-2-8-15/h4,6,10,17H,2-3,5,7-9,15H2,1H3,(H,16,18)

InChIKey

DDSIZVYRTNDIJL-UHFFFAOYSA-N

SMILES

O=C(NCCCCN)CCC1=CC(OC)=C(O)C=C1

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)propanimidic acid (CHEBI:186625) is a methoxybenzenes (CHEBI:51683) N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)propanimidic acid (CHEBI:186625) is a phenols (CHEBI:33853)

IUPAC Name

N-(4-aminobutyl)-3-(4-hydroxy-3-methoxyphenyl)propanamide