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CHEBI:85312 - β-D-galacturonate

ChEBI IDCHEBI:85312
ChEBI Nameβ-D-galacturonate
Stars
ASCII Namebeta-D-galacturonate
DefinitionA D-galactopyranuronate that has β configuration at the anomeric centre.
Last Modified1 May 2015
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC6H9O7
Net Charge-1
Average Mass193.131
Monoisotopic Mass193.03538
SMILESO=C([O-])[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/p-1/t1-,2+,3+,4-,6+/m0/s1
InChIKeyAEMOLEFTQBMNLQ-DTEWXJGMSA-M
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
β-D-galacturonate (CHEBI:85312) is a D-galactopyranuronate (CHEBI:75525)
β-D-galacturonate (CHEBI:85312) is conjugate base of β-D-galacturonic acid (CHEBI:47954)
Incoming Relation(s)
β-D-galacturonic acid (CHEBI:47954) is conjugate acid of β-D-galacturonate (CHEBI:85312)
IUPAC Name 
β-D-galactopyranuronate
UniProt Name  Source
β-D-galacturonateUniProt
Manual XrefsDatabases
CPD-12524MetaCyc
Registry NumbersSources
Reaxys:5747264Reaxys