Showing metabocard for 3-carboxy-2,5-dihydro-5-oxofuran-2-acetic acid (MMDBc0055351)
Record Information | |||||||||||||||||
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Version | 1.0 | ||||||||||||||||
Status | Detected and Quantified | ||||||||||||||||
Creation Date | 2022-06-17 19:49:50 UTC | ||||||||||||||||
Update Date | 2022-08-12 20:09:21 UTC | ||||||||||||||||
Metabolite ID | MMDBc0055351 | ||||||||||||||||
Metabolite Identification | |||||||||||||||||
Common Name | 3-carboxy-2,5-dihydro-5-oxofuran-2-acetic acid | ||||||||||||||||
Description | 2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate, also known as 3-carboxy-2,5-dihydro-5-oxofuran-2-acetate, belongs to the class of organic compounds known as furoic acids. These are organic compounds containing a furoic acid moiety, with a structure characterized by a furan ring bearing a carboxylic acid group at the C2 or C3 carbon atom. Based on a literature review very few articles have been published on 2-(carboxylatomethyl)-5-oxo-2,5-dihydrofuran-2-ide-3-carboxylate. | ||||||||||||||||
Structure | |||||||||||||||||
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Molecular Formula | C7H3O6 | ||||||||||||||||
Average Mass | 183.097 | ||||||||||||||||
Monoisotopic Mass | 182.994608556 | ||||||||||||||||
IUPAC Name | 5-(carboxymethyl)-2-oxo-2,3-dihydrofuran-3-ide-4-carboxylate | ||||||||||||||||
Traditional Name | 5-(carboxymethyl)-2-oxo-3H-furan-3-ide-4-carboxylate | ||||||||||||||||
CAS Registry Number | Not Available | ||||||||||||||||
SMILES | [O-]C(=O)CC1=C([CH-]C(=O)O1)C([O-])=O | ||||||||||||||||
InChI Identifier | InChI=1S/C7H5O6/c8-5(9)2-4-3(7(11)12)1-6(10)13-4/h1H,2H2,(H,8,9)(H,11,12)/q-1/p-2 | ||||||||||||||||
InChI Key | YTGSUEIQIFKYDP-UHFFFAOYSA-L | ||||||||||||||||
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