(4S)-2,4-dimethyl-5-oxo-2,5-dihydrofuran-3-carboxylic acid (CHEBI:197616)

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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	(4S)-2,4-dimethyl-5-oxo-2,5-dihydrofuran-3-carboxylic acid

ChEBI ID	CHEBI:197616

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C7H8O4

Net Charge

Average Mass

156.137

Monoisotopic Mass

156.04226

InChI

InChI=1S/C7H8O4/c1-3-5(6(8)9)4(2)11-7(3)10/h4H,1-2H3,(H,8,9)/t4-/m0/s1

InChIKey

MXIUVOVXWKGXDD-BYPYZUCNSA-N

SMILES

O=C1O[C@@H](C)C(=C1C)C(=O)O

Metabolite of Species	Details
Graphis scripta (NCBI:txid71600)	See: DOI

ChEBI Ontology
Outgoing	(4S)-2,4-dimethyl-5-oxo-2,5-dihydrofuran-3-carboxylic acid (CHEBI:197616) is a butenolide (CHEBI:50523)

IUPAC Name

(2S)-2,4-dimethyl-5-oxo-2H-uran-3-carboxylic acid