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CHEBI:85538 - (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate

ChEBI IDCHEBI:85538
ChEBI Name(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate
Stars
ASCII Name(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate
DefinitionA (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate obtained by deprotonation of the carboxy group of (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid; major species at pH 7.3.
Last Modified25 June 2024
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC6H4ClO4
Net Charge-1
Average Mass175.547
Monoisotopic Mass174.98036
SMILESO=C([O-])C[C@@]1(Cl)C=CC(=O)O1
InChIInChI=1S/C6H5ClO4/c7-6(3-4(8)9)2-1-5(10)11-6/h1-2H,3H2,(H,8,9)/p-1/t6-/m1/s1
InChIKeyWGZZDRVKIXVYEI-ZCFIWIBFSA-M
Species of MetaboliteComponentSourceComments
Pseudomonas sp. P51 (ncbitaxon:65067) - PubMed (12930985)
Roles Classification
Biological Role:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate (CHEBI:85538) has role bacterial metabolite (CHEBI:76969)
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate (CHEBI:85538) is a (2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate (CHEBI:58109)
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate (CHEBI:85538) is conjugate base of (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid (CHEBI:85800)
Incoming Relation(s)
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid (CHEBI:85800) is conjugate acid of (R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate (CHEBI:85538)
IUPAC Name 
[(2R)-2-chloro-5-oxo-2,5-dihydrofuran-2-yl]acetate
Synonyms  Source
(R)-2-chloro-2,5-dihydro-5-oxofuran-2-acetateSUBMITTER
(+)-4-chloromuconolactone(1−)SUBMITTER
UniProt Name  Source
2-[(2R)-2-chloro-2,5-dihydro-5-oxofuryl]acetateUniProt
Manual XrefsDatabases
2-CL-5-OXO-2-5-DIH-FURAN-2-ACETATEMetaCyc
Citations