Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-06-17 19:46:01 UTC
Update Date2022-08-12 20:09:16 UTC
Metabolite IDMMDBc0055198
Metabolite Identification
Common Name2-(5-oxo-2,5-dihydrofuran-2-ylidene)acetic acid
Description4-carboxylatomethylenebut-2-en-4-olide, also known as 2-(5-oxo-2,5-dihydrofuran-2-ylidene)acetate, belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom. Based on a literature review very few articles have been published on 4-carboxylatomethylenebut-2-en-4-olide.
Structure
Synonyms
ValueSource
2-(5-oxo-2,5-Dihydrofuran-2-ylidene)acetateChEBI
2-(5-oxo-2,5-Dihydrofuran-2-ylidene)acetic acidGenerator
Molecular FormulaC6H3O4
Average Mass139.087
Monoisotopic Mass139.003682157
IUPAC Name2-(5-oxo-2,5-dihydrofuran-2-ylidene)acetate
Traditional Name(5-oxofuran-2-ylidene)acetate
CAS Registry NumberNot Available
SMILES
[O-]C(=O)C=C1OC(=O)C=C1
InChI Identifier
InChI=1S/C6H4O4/c7-5(8)3-4-1-2-6(9)10-4/h1-3H,(H,7,8)/p-1
InChI KeyAYFXPGXAZMFWNH-UHFFFAOYSA-M