Peniginseng A (CHEBI:198718)

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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	Peniginseng A

ChEBI ID	CHEBI:198718

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

Submitter	MetaboLights

Supplier Information

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Formula

C11H13NO5

Net Charge

Average Mass

239.227

Monoisotopic Mass

239.07937

InChI

InChI=1S/C11H13NO5/c1-17-10(15)4-5-12-11(16)7-2-3-8(13)9(14)6-7/h2-3,6,13-14H,4-5H2,1H3,(H,12,16)

InChIKey

XZEGVGFUZLXOSR-UHFFFAOYSA-N

SMILES

O=C(NCCC(=O)OC)C1=CC(O)=C(O)C=C1

Metabolite of Species	Details
Penicilliumspecies YIM PH 30003 (NCBI:txid1564175)	See: DOI

ChEBI Ontology
Outgoing	Peniginseng A (CHEBI:198718) has functional parent β-amino acid (CHEBI:33706) Peniginseng A (CHEBI:198718) is a organonitrogen compound (CHEBI:35352) Peniginseng A (CHEBI:198718) is a organooxygen compound (CHEBI:36963)

IUPAC Name

methyl 3-[(3,4-dihydroxybenzoyl)amino]propanoate