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CHEBI:17416 - 3,4-dihydroxyphthalic acid

ChEBI IDCHEBI:17416
ChEBI Name3,4-dihydroxyphthalic acid
Stars
Secondary ChEBI IDsCHEBI:1388, CHEBI:11699, CHEBI:19892
Last Modified9 December 2024
DownloadsMolfile
FormulaC8H6O6
Net Charge0
Average Mass198.130
Monoisotopic Mass198.01644
SMILESO=C(O)c1ccc(O)c(O)c1C(=O)O
InChIInChI=1S/C8H6O6/c9-4-2-1-3(7(11)12)5(6(4)10)8(13)14/h1-2,9-10H,(H,11,12)(H,13,14)
InChIKeyQXGJCWSBOZXWOV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
3,4-dihydroxyphthalic acid (CHEBI:17416) has functional parent phthalic acid (CHEBI:29069)
3,4-dihydroxyphthalic acid (CHEBI:17416) is a hydroxybenzoic acid (CHEBI:24676)
3,4-dihydroxyphthalic acid (CHEBI:17416) is conjugate acid of 3,4-dihydroxyphthalate(2−) (CHEBI:58137)
Incoming Relation(s)
3,4-dihydroxyphthalate(2−) (CHEBI:58137) is conjugate base of 3,4-dihydroxyphthalic acid (CHEBI:17416)
IUPAC Name 
3,4-dihydroxyphthalic acid
Synonyms  Source
3,4-DihydroxyphthalateKEGG COMPOUND
3,4-Dihydroxyphthalic acidKEGG COMPOUND
Manual XrefsDatabases
C03223KEGG COMPOUND
C03223KEGG COMPOUND
Registry NumbersSources
CAS:82784-82-5KEGG COMPOUND