CHEBI:45969 - tricarballylic acid

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ChEBI Name tricarballylic acid
ChEBI ID CHEBI:45969
Definition A tricarboxylic acid that is glutaric acid in which one of the β-hydrogens is substituted by a carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C6H8O6
Net Charge 0
Average Mass 176.12410
Monoisotopic Mass 176.03209
InChI InChI=1S/C6H8O6/c7-4(8)1-3(6(11)12)2-5(9)10/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey KQTIIICEAUMSDG-UHFFFAOYSA-N
SMILES OC(=O)CC(CC(O)=O)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing tricarballylic acid (CHEBI:45969) is a tricarboxylic acid (CHEBI:27093)
tricarballylic acid (CHEBI:45969) is conjugate acid of tricarballylate (CHEBI:62517)
Incoming fumonisin (CHEBI:38224) has functional parent tricarballylic acid (CHEBI:45969)
tricarballylate (CHEBI:62517) is conjugate base of tricarballylic acid (CHEBI:45969)
IUPAC Name
propane-1,2,3-tricarboxylic acid
Synonyms Sources
1,2,3-propanetricarboxylic acid ChemIDplus
3-carboxyglutaric acid ChEBI
3-carboxypentanedioic acid ChEBI
β-carboxyglutaric acid ChemIDplus
carballylic acid ChEBI
carboxymethylsuccinic acid ChEBI
TRICARBALLYLIC ACID PDBeChem
Manual Xrefs Databases
LSM-37013 LINCS
TRC PDBeChem
View more database links
Registry Numbers Types Sources
1783567 Reaxys Registry Number Reaxys
99-14-9 CAS Registry Number NIST Chemistry WebBook
99-14-9 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
19922747 PubMed citation Europe PMC
Last Modified
28 November 2016