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CHEBI:87985 - 1,1,1-propanetricarboxylate

ChEBI IDCHEBI:87985
ChEBI Name1,1,1-propanetricarboxylate
Stars
DefinitionA tricarboxylic acid trianion obtained by deprotonation of the carboxy groups of 1,1,1-propanetricarboxylic acid.
Last Modified4 March 2016
Submittermwilliams
DownloadsMolfile
FormulaC6H5O6
Net Charge-3
Average Mass173.100
Monoisotopic Mass173.01026
SMILESCCC(C(=O)[O-])(C(=O)[O-])C(=O)[O-]
InChIInChI=1S/C6H8O6/c1-2-6(3(7)8,4(9)10)5(11)12/h2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/p-3
InChIKeyCEGRHPCDLKAHJD-UHFFFAOYSA-K
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) - MetaboLights (MTBLS171)
ChEBI Ontology
Outgoing Relation(s)
1,1,1-propanetricarboxylate (CHEBI:87985) is a tricarboxylic acid trianion (CHEBI:27092)
1,1,1-propanetricarboxylate (CHEBI:87985) is conjugate base of 1,1,1-propanetricarboxylic acid (CHEBI:100148)
Incoming Relation(s)
1,1,1-propanetricarboxylic acid (CHEBI:100148) is conjugate acid of 1,1,1-propanetricarboxylate (CHEBI:87985)
IUPAC Name 
propane-1,1,1-tricarboxylate
Manual XrefsDatabases
10608344ChemSpider