CHEBI:49108 - dopachrome

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name dopachrome
ChEBI ID CHEBI:49108
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H7NO4
Net Charge 0
Average Mass 193.15622
Monoisotopic Mass 193.038
InChI InChI=1S/C9H7NO4/c11-7-2-4-1-6(9(13)14)10-5(4)3-8(7)12/h2-3,6,10H,1H2,(H,13,14)
InChIKey VJNCICVKUHKIIV-UHFFFAOYSA-N
SMILES OC(=O)C1CC2=CC(=O)C(=O)C=C2N1
ChEBI Ontology
Outgoing dopachrome (CHEBI:49108) is a orthoquinones (CHEBI:25622)
dopachrome (CHEBI:49108) is tautomer of 5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003)
Incoming D-dopachrome (CHEBI:49109) is a dopachrome (CHEBI:49108)
L-dopachrome (CHEBI:15772) is a dopachrome (CHEBI:49108)
5,6-dihydroxyindole-2-carboxylic acid (CHEBI:2003) is tautomer of dopachrome (CHEBI:49108)
IUPAC Name
5,6-dioxo-2,3,5,6-tetrahydro-1H-indole-2-carboxylic acid
Synonym Source
2,3,5,6-tetrahydro-5,6-dioxo-1H-indole-2-carboxylic acid ChemIDplus
Registry Numbers Types Sources
181818 Beilstein Registry Number Beilstein
3571-34-4 CAS Registry Number ChemIDplus
Last Modified
02 June 2016