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CHEBI:75057 - 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion

ChEBI IDCHEBI:75057
ChEBI Name2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion
Stars
ASCII Name2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion
DefinitionAn amino acid zwitterion obtained by transfer of a proton from the amino to the carboxy group of 2-amino-5-chloro-cis,cis-muconic 6-semialdehyde
Last Modified22 August 2013
SubmitterKAX
DownloadsMolfile
FormulaC6H6ClNO3
Net Charge0
Average Mass175.571
Monoisotopic Mass175.00362
SMILES[H]C(=O)/C(Cl)=C\C=C(\[NH3+])C(=O)[O-]
InChIInChI=1S/C6H6ClNO3/c7-4(3-9)1-2-5(8)6(10)11/h1-3H,8H2,(H,10,11)/b4-1+,5-2+
InChIKeyYEIFVAPTZWXPNE-GRSRPBPQSA-N
ChEBI Ontology
Outgoing Relation(s)
2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion (CHEBI:75057) is a amino-acid zwitterion (CHEBI:35238)
2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion (CHEBI:75057) is a organic molecular entity (CHEBI:50860)
2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion (CHEBI:75057) is tautomer of 2-amino-5-chloro-cis,cis-muconic 6-semialdehyde (CHEBI:75320)
Incoming Relation(s)
2-amino-5-chloro-cis,cis-muconic 6-semialdehyde (CHEBI:75320) is tautomer of 2-amino-5-chloro-cis,cis-muconate 6-semialdehyde zwitterion (CHEBI:75057)
Synonym  Source
(2E,4E)-2-azaniumyl-5-chloro-6-oxohexa-2,4-dienoateChEBI
UniProt Name  Source
2-amino-5-chloromuconate 6-semialdehydeUniProt
Manual XrefsDatabases
CPD-9161MetaCyc
Citations