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CHEBI:231766 - leucodopachrome zwitterion

ChEBI IDCHEBI:231766
ChEBI Nameleucodopachrome zwitterion
Stars
DefinitionA zwitterion resulting from the transfer of a proton from the carboxy group to the amino group of leucodopachrome; Major microspecies at pH 7.3.
Last Modified26 September 2024
SubmitterAnne Morgat
DownloadsMolfile
FormulaC9H9NO4
Net Charge0
Average Mass195.174
Monoisotopic Mass195.05316
SMILESO=C([O-])[C@@H]1Cc2cc(O)c(O)cc2[NH2+]1
InChIInChI=1S/C9H9NO4/c11-7-2-4-1-6(9(13)14)10-5(4)3-8(7)12/h2-3,6,10-12H,1H2,(H,13,14)/t6-/m0/s1
InChIKeyJDWYRSDDJVCWPB-LURJTMIESA-N
ChEBI Ontology
Outgoing Relation(s)
leucodopachrome zwitterion (CHEBI:231766) is a zwitterion (CHEBI:27369)
leucodopachrome zwitterion (CHEBI:231766) is tautomer of leucodopachrome (CHEBI:60872)
Incoming Relation(s)
leucodopachrome (CHEBI:60872) is tautomer of leucodopachrome zwitterion (CHEBI:231766)
IUPAC Name 
(2S)-5,6-dihydroxy-2,3-dihydro-1H-indolium-2-carboxylate
Synonyms  Source
cyclo-dopa zwitterionChEBI
(S)-5,6-dihydroxyindolinium-2-carboxylateChEBI
UniProt Name  Source
leucodopachromeUniProt
Manual XrefsDatabases
CPD-8652MetaCyc
Citations