Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-17 23:51:10 UTC
Update Date2022-08-31 17:38:50 UTC
Metabolite IDMMDBc0030027
Metabolite Identification
Common Name5-Dehydro-4-deoxy-D-glucuronate
Description5-dehydro-4-deoxy-D-glucuronate is a member of the chemical class known as Medium-chain Keto Acids and Derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain.
Structure
Synonyms
ValueSource
4-Deoxy-L-threo-5-hexulosuronic acidChEBI
4-Deoxy-L-threo-5-hexosulose uronateKegg
4-Deoxy-L-threo-5-hexulosuronateGenerator
4-Deoxy-L-threo-5-hexosulose uronic acidGenerator
5-Dehydro-4-deoxy-D-glucuronic acidGenerator
Molecular FormulaC6H8O6
Average Mass176.1241
Monoisotopic Mass176.032087988
IUPAC Name(4S,5R)-4,5-dihydroxy-2,6-dioxohexanoic acid
Traditional Name(4S,5R)-4,5-dihydroxy-2,6-dioxohexanoic acid
CAS Registry NumberNot Available
SMILES
[H][C@](O)(CC(=O)C(O)=O)[C@@]([H])(O)C=O
InChI Identifier
InChI=1S/C6H8O6/c7-2-5(10)3(8)1-4(9)6(11)12/h2-3,5,8,10H,1H2,(H,11,12)/t3-,5-/m0/s1
InChI KeyIMUGYKFHMJLTOU-UCORVYFPSA-N