CHEBI:17199 - 4,5-dihydroxyphthalic acid

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ChEBI Name 4,5-dihydroxyphthalic acid
ChEBI ID CHEBI:17199
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:1746, CHEBI:11924, CHEBI:20273
Supplier Information
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Formula C8H6O6
Net Charge 0
Average Mass 198.12964
Monoisotopic Mass 198.01644
InChI InChI=1S/C8H6O6/c9-5-1-3(7(11)12)4(8(13)14)2-6(5)10/h1-2,9-10H,(H,11,12)(H,13,14)
InChIKey YZBCICVNBHNLTK-UHFFFAOYSA-N
SMILES OC(=O)c1cc(O)c(O)cc1C(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 4,5-dihydroxyphthalic acid (CHEBI:17199) has functional parent phthalic acid (CHEBI:29069)
4,5-dihydroxyphthalic acid (CHEBI:17199) is a benzenedicarboxylic acid (CHEBI:26094)
4,5-dihydroxyphthalic acid (CHEBI:17199) is conjugate acid of 4,5-dihydroxyphthalate(2−) (CHEBI:58051)
Incoming 4,5-dihydroxyphthalate(2−) (CHEBI:58051) is conjugate base of 4,5-dihydroxyphthalic acid (CHEBI:17199)
IUPAC Name
4,5-dihydroxyphthalic acid
Synonyms Sources
4,5-Dihydroxyphthalate KEGG COMPOUND
4,5-Dihydroxyphthalic acid KEGG COMPOUND
Manual Xrefs Databases
c0183 UM-BBD
C03233 KEGG COMPOUND
View more database links
Registry Number Type Source
63958-66-7 CAS Registry Number KEGG COMPOUND
Last Modified
10 January 2019