N-trans-Feruloyloctopamine (CHEBI:191530)

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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-trans-Feruloyloctopamine

ChEBI ID	CHEBI:191530

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H19NO5

Net Charge

Average Mass

329.352

Monoisotopic Mass

329.12632

InChI

InChI=1S/C18H19NO5/c1-24-17-10-12(2-8-15(17)21)3-9-18(23)19-11-16(22)13-4-6-14(20)7-5-13/h2-10,16,20-22H,11H2,1H3,(H,19,23)/b9-3+

InChIKey

VJSCHQMOTSXAKB-YCRREMRBSA-N

SMILES

OC(CNC(=O)/C=C/C1=CC(OC)=C(O)C=C1)C2=CC=C(O)C=C2

Metabolite of Species	Details
Solanum tuberosum (NCBI:txid4113)	Found in leaf (BTO:0000713). See: MetaboLights Study
Ulmus parvifolia (NCBI:txid63058)	Found in seed (BTO:0001226). See: MetaboLights Study
Ulmus parvifolia (NCBI:txid63058)	Found in bark (BTO:0001301). See: MetaboLights Study

ChEBI Ontology
Outgoing	N-trans-Feruloyloctopamine (CHEBI:191530) is a methoxybenzenes (CHEBI:51683) N-trans-Feruloyloctopamine (CHEBI:191530) is a phenols (CHEBI:33853)

IUPAC Name

(E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide