CHEBI:177632 - 1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid

ChEBI IDCHEBI:177632
ChEBI Name1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H12O6
Net Charge0
Average Mass192.167
Monoisotopic Mass192.06339
SMILESO=C(O)C1(O)CC(O)C(O)C(O)C1
InChIInChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)
InChIKeyAAWZDTNXLSGCEK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
1,3,4,5-Tetrahydroxycyclohexanecarboxylic acid (CHEBI:177632) is a quinic acid (CHEBI:26493)
IUPAC Name 
1,3,4,5-tetrahydroxycyclohexane-1-carboxylic acid
Manual XrefsDatabases
1035ChemSpider
Registry NumbersSources
CAS:562-73-2ChemIDplus