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CHEBI:177449 - 1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid

ChEBI IDCHEBI:177449
ChEBI Name1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H10O6
Net Charge0
Average Mass190.151
Monoisotopic Mass190.04774
SMILESO=C1CC(O)(C(=O)O)CC(O)C1O
InChIInChI=1S/C7H10O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3,5,8,10,13H,1-2H2,(H,11,12)
InChIKeyWVMWZWGZRAXUBK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) Sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid (CHEBI:177449) is a hydroxy monocarboxylic acid (CHEBI:35868)
IUPAC Name 
1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid
Manual XrefsDatabases
610ChemSpider