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CHEBI:36062 - 3,4-dihydroxybenzoic acid

ChEBI IDCHEBI:36062
ChEBI Name3,4-dihydroxybenzoic acid
Stars
DefinitionA dihydroxybenzoic acid in which the hydroxy groups are located at positions 3 and 4.
Secondary ChEBI IDsCHEBI:1380, CHEBI:16798, CHEBI:19879, CHEBI:20270, CHEBI:20272, CHEBI:41912
Last Modified5 July 2016
DownloadsMolfile

FormulaC7H6O4
Net Charge0
Average Mass154.121
Monoisotopic Mass154.02661
SMILESO=C(O)c1ccc(O)c(O)c1
InChIInChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)
InChIKeyYQUVCSBJEUQKSH-UHFFFAOYSA-N

Wikipedia
Species of MetaboliteComponentSourceComments
Cordyceps sinensis (ncbitaxon:72228) mycelium (BTO:0001436) PubMed (21848266) Ethanolic extract of dried mycelia
Ficus mucuso (ncbitaxon:309328) fruit (BTO:0000486) PubMed (21619045) Methanolic extract of air-dried and powdered figs(fruits)
Oryza sativa (ncbitaxon:4530) - PubMed (20973550)
Alpinia (ncbitaxon:94326) - PubMed (20973550)
Origanum vulgare (ncbitaxon:39352) aerial part (BTO:0001658) PubMed (20973550) 95% EtOH extract of dried and powdered aerial parts
Roles Classification

ChEBI Ontology
IUPAC Name 
3,4-dihydroxybenzoic acid
Synonyms  Source
3,4-Dihydroxybenzoic acidKEGG COMPOUND
Protocatechuic acidKEGG COMPOUND
Protocatehuic acidChemIDplus
Protocatechuic acidChemIDplus
4,5-Dihydroxybenzoic acidChemIDplus
4-Carboxy-1,2-dihydroxybenzeneChemIDplus
Manual XrefsDatabases
C00230KEGG COMPOUND
DHBPDBeChem
3-4-DIHYDROXYBENZOATEMetaCyc
Protocatechuic_acidWikipedia
HMDB0001856HMDB
C00002668KNApSAcK
Registry NumbersSources
Reaxys:1448841Reaxys
CAS:99-50-3KEGG COMPOUND
CAS:99-50-3ChemIDplus
CAS:99-50-3NIST Chemistry WebBook
Citations