CHEBI:19643 - 2-hydroxyisophthalic acid

ChEBI IDCHEBI:19643
ChEBI Name2-hydroxyisophthalic acid
Stars
DefinitionA hydroxybenzoic acid that is isophthalic acid in which the hydrogen at position 2 is substituted by a hydroxy group.
Secondary ChEBI IDCHEBI:34290
Last Modified26 April 2021
DownloadsMolfile
FormulaC8H6O5
Net Charge0
Average Mass182.131
Monoisotopic Mass182.02152
SMILESO=C(O)c1cccc(C(=O)O)c1O
InChIInChI=1S/C8H6O5/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3,9H,(H,10,11)(H,12,13)
InChIKeyWVDGHGISNBRCAO-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)
2-hydroxyisophthalic acid (CHEBI:19643) has functional parent isophthalic acid (CHEBI:30802)
2-hydroxyisophthalic acid (CHEBI:19643) is a hydroxybenzoic acid (CHEBI:24676)
2-hydroxyisophthalic acid (CHEBI:19643) is a phenols (CHEBI:33853)
Incoming Relation(s)
(+/-)-strobide B (CHEBI:227915) is a 2-hydroxyisophthalic acid (CHEBI:19643)
2,6-dimethoxy terephthalic acid (CHEBI:207737) is a 2-hydroxyisophthalic acid (CHEBI:19643)
4-[(1-naphthalenylamino)-oxomethyl]benzene-1,3-dicarboxylic acid (CHEBI:107186) is a 2-hydroxyisophthalic acid (CHEBI:19643)
4-Hydroxyisophthalic acid (CHEBI:229985) is a 2-hydroxyisophthalic acid (CHEBI:19643)
5-[(1,3-dimethyl-2,4-dioxo-6-quinazolinyl)sulfonylamino]benzene-1,3-dicarboxylic acid (CHEBI:123183) is a 2-hydroxyisophthalic acid (CHEBI:19643)
5-[3-[[[[3-(dimethylamino)phenyl]-oxomethyl]hydrazinylidene]methyl]-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid (CHEBI:109632) is a 2-hydroxyisophthalic acid (CHEBI:19643)
5-Carboxyvanillic acid (CHEBI:81684) is a 2-hydroxyisophthalic acid (CHEBI:19643)
5-Hydroxyisophthalic acid (CHEBI:229984) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Ascolactone A (CHEBI:203295) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Ascolactone B (CHEBI:205515) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Biscogniphthalide C (CHEBI:211147) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Chlorthal (CHEBI:179164) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Convolvulanic acid A (CHEBI:204069) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Convolvulanic acid B (CHEBI:216688) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Di-n-hexyl phthalate (CHEBI:34678) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Dihydrocitrinone (CHEBI:235420) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Fendlerinine A (CHEBI:214799) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Penipyranicin C (CHEBI:225526) is a 2-hydroxyisophthalic acid (CHEBI:19643)
Xylarphthalide A (CHEBI:220684) is a 2-hydroxyisophthalic acid (CHEBI:19643)
IUPAC Name 
2-hydroxybenzene-1,3-dicarboxylic acid
Synonym  Source
2-Hydroxy-1,3-benzenedicarboxylic acidKEGG COMPOUND
Manual XrefsDatabases
c0729UM-BBD
C14097KEGG COMPOUND
Registry NumbersSources
Reaxys:2102863Reaxys
CAS:606-19-9KEGG COMPOUND
CAS:606-19-9ChemIDplus