CHEBI:2003 - 5,6-dihydroxyindole-2-carboxylic acid

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ChEBI Name 5,6-dihydroxyindole-2-carboxylic acid
ChEBI ID CHEBI:2003
Definition A dihydroxyindole that is indole-2-carboxylic acid substituted by hydroxy groups at positions 5 and 6.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H7NO4
Net Charge 0
Average Mass 193.15620
Monoisotopic Mass 193.038
InChI InChI=1S/C9H7NO4/c11-7-2-4-1-6(9(13)14)10-5(4)3-8(7)12/h1-3,10-12H,(H,13,14)
InChIKey YFTGOBNOJKXZJC-UHFFFAOYSA-N
SMILES OC(=O)c1cc2cc(O)c(O)cc2[nH]1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
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ChEBI Ontology
Outgoing 5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003) has role mouse metabolite (CHEBI:75771)
5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003) is a dihydroxyindole (CHEBI:23781)
5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003) is conjugate acid of 5,6-dihydroxyindole-2-carboxylate (CHEBI:16875)
5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003) is tautomer of dopachrome (CHEBI:49108)
Incoming 5,6-dihydroxyindole-2-carboxylate (CHEBI:16875) is conjugate base of 5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003)
dopachrome (CHEBI:49108) is tautomer of 5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003)
IUPAC Name
5,6-dihydroxy-1H-indole-2-carboxylic acid
Synonyms Sources
5,6-DHICA ChemIDplus
5,6-dihydroxy-2-indolecarboxylic acid ChemIDplus
5,6-dihydroxy-2-indolylcarboxylic acid ChemIDplus
5,6-Dihydroxyindole-2-carboxylate KEGG COMPOUND
DHI2C ChemIDplus
DHICA KEGG COMPOUND
Manual Xref Database
C04185 KEGG COMPOUND
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Registry Numbers Types Sources
168167 Beilstein Registry Number Beilstein
168167 Reaxys Registry Number Reaxys
4790-08-3 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
25450182 PubMed citation Europe PMC
Last Modified
27 January 2016