CHEBI:46032 - benzene-1,3,5-tricarboxylic acid

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ChEBI Name benzene-1,3,5-tricarboxylic acid
Definition A tricarboxylic acid that consists of benzene substituted by carboxy groups at positions 1, 3 and 5.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:46030, CHEBI:33058
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Formula C9H6O6
Net Charge 0
Average Mass 210.14034
Monoisotopic Mass 210.016
InChI InChI=1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)
SMILES OC(=O)c1cc(cc(c1)C(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 )
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ChEBI Ontology
Outgoing benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is a benzoic acids (CHEBI:22723)
benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is a tricarboxylic acid (CHEBI:27093)
benzene-1,3,5-tricarboxylic acid (CHEBI:46032) is conjugate acid of benzene-1,3,5-tricarboxylate(1−) (CHEBI:33061)
Incoming N,N',N''-tris(3-pyridyl)benzene-1,3,5-tricarboxamide (CHEBI:52612) has functional parent benzene-1,3,5-tricarboxylic acid (CHEBI:46032)
benzene-1,3,5-tricarboxylate(1−) (CHEBI:33061) is conjugate base of benzene-1,3,5-tricarboxylic acid (CHEBI:46032)
benzene-1,3,5-tricarboxylic acid
Synonyms Sources
1,3,5-tricarboxybenzene NIST Chemistry WebBook
5-carboxyisophthalic acid ChemIDplus
trimesic acid ChemIDplus
trimesinic acid NIST Chemistry WebBook
trimesitinic acid NIST Chemistry WebBook
Manual Xrefs Databases
DB08632 DrugBank
Trimesic_acid Wikipedia
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Registry Numbers Types Sources
2053080 Beilstein Registry Number Beilstein
2053080 Reaxys Registry Number Reaxys
51147 Gmelin Registry Number Gmelin
554-95-0 CAS Registry Number NIST Chemistry WebBook
554-95-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
21727049 PubMed citation Europe PMC
23944842 PubMed citation Europe PMC
24399224 PubMed citation Europe PMC
Last Modified
07 March 2018