Wyeronic acid (CHEBI:168520)

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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	Wyeronic acid

ChEBI ID	CHEBI:168520

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H10O4

Net Charge

Average Mass

230.219

Monoisotopic Mass

230.05791

InChI

InChI=1S/C13H10O4/c1-2-3-4-5-11(14)12-8-6-10(17-12)7-9-13(15)16/h2-3,6-9H,1H3,(H,15,16)/b3-2+,9-7-

InChIKey

DMVOIMZYBMLJHN-XKURDXHJSA-N

SMILES

O1C(=CC=C1C(=O)C#C/C=C/C)/C=C\C(O)=O

Metabolite of Species	Details
Malus domestica (NCBI:txid3750)	Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Wyeronic acid (CHEBI:168520) is a heterocyclic fatty acid (CHEBI:48847)

IUPAC Name

(Z)-3-[5-[(E)-hex-4-en-2-ynoyl]uran-2-yl]prop-2-enoic acid