CHEBI:88714 - 2,3,4-trihydroxybenzoic acid

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ChEBI Name 2,3,4-trihydroxybenzoic acid
ChEBI ID CHEBI:88714
Definition A trihydroxybenzoic acid that is benzoic acid substituted by hydroxy groups at positions 2, 3, and 4.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB0259026, eMolecules:35875953, eMolecules:12800964, ZINC000031155604
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Formula C7H6O5
Net Charge 0
Average Mass 170.120
Monoisotopic Mass 170.02152
InChI InChI=1S/C7H6O5/c8-4-2-1-3(7(11)12)5(9)6(4)10/h1-2,8-10H,(H,11,12)
InChIKey BRRSNXCXLSVPFC-UHFFFAOYSA-N
SMILES OC(=O)C1=CC=C(O)C(O)=C1O
Metabolite of Species Details
Quercus mongolica (NCBI:txid103485) Found in leaf (BTO:0000713). See: PubMed
Roles Classification
Chemical Role(s): radical scavenger
A role played by a substance that can react readily with, and thereby eliminate, radicals.
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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ChEBI Ontology
Outgoing 2,3,4-trihydroxybenzoic acid (CHEBI:88714) has role plant metabolite (CHEBI:76924)
2,3,4-trihydroxybenzoic acid (CHEBI:88714) has role radical scavenger (CHEBI:48578)
2,3,4-trihydroxybenzoic acid (CHEBI:88714) is a monocarboxylic acid (CHEBI:25384)
2,3,4-trihydroxybenzoic acid (CHEBI:88714) is a trihydroxybenzoic acid (CHEBI:27115)
IUPAC Name
2,3,4-trihydroxybenzoic acid
Synonyms Sources
2,3,4-THBA ChEBI
2,3,4-trihydroxybenzenecarboxylic acid ChEBI
4-pyrogallolcarboxylic acid NIST Chemistry WebBook
pyrogallic acid-4-carboxylic acid NIST Chemistry WebBook
pyrogallol-4-carboxylic acid ChEBI
Manual Xrefs Databases
C00055642 KNApSAcK
HMDB0059964 HMDB
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Registry Numbers Types Sources
2210807 Reaxys Registry Number Reaxys
610-02-6 CAS Registry Number NIST Chemistry WebBook
Citations Types Sources
11707949 PubMed citation Europe PMC
11879044 PubMed citation Europe PMC
17617723 PubMed citation Europe PMC
17969689 PubMed citation Europe PMC
18680298 PubMed citation Europe PMC
18990494 PubMed citation Europe PMC
19812218 PubMed citation Europe PMC
20939276 PubMed citation Europe PMC
26273895 PubMed citation Europe PMC
33491781 PubMed citation Europe PMC
35565898 PubMed citation Europe PMC
35628552 PubMed citation Europe PMC
36235188 PubMed citation Europe PMC
37611226 PubMed citation Europe PMC
8572608 PubMed citation Europe PMC
IND607254944 Agricola citation Europe PMC
Last Modified
12 June 2024