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CHEBI:189177 - Itatartaric acid

ChEBI IDCHEBI:189177
ChEBI NameItatartaric acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC5H8O6
Net Charge0
Average Mass164.113
Monoisotopic Mass164.03209
SMILESO=C(O)C[C@@](O)(CO)C(=O)O
InChIInChI=1S/C5H8O6/c6-2-5(11,4(9)10)1-3(7)8/h6,11H,1-2H2,(H,7,8)(H,9,10)/t5-/m1/s1
InChIKeyQKDVEGVVCQTJPD-RXMQYKEDSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Itatartaric acid (CHEBI:189177) is a hydroxy fatty acid (CHEBI:24654)
IUPAC Name 
(2R)-2-hydroxy-2-(hydroxymethyl)butanedioic acid
Manual XrefsDatabases
2340941ChemSpider
Registry NumbersSources
CAS:9/7/2957ChemIDplus