CHEBI:194198 - 5-deoxy-5-aminoshikimic acid zwitterion

ChEBI IDCHEBI:194198
ChEBI Name5-deoxy-5-aminoshikimic acid zwitterion
Stars
DefinitionMajor microspecies at pH 7.3.
SubmitterAnne Morgat
DownloadsMolfile
FormulaC7H11NO4
Net Charge0
Average Mass173.168
Monoisotopic Mass173.06881
SMILES[NH3+][C@@H]1CC(C(=O)[O-])=C[C@@H](O)[C@H]1O
InChIInChI=1S/C7H11NO4/c8-4-1-3(7(11)12)2-5(9)6(4)10/h2,4-6,9-10H,1,8H2,(H,11,12)/t4-,5-,6+/m1/s1
InChIKeyGSAKPGCLECHWSP-PBXRRBTRSA-N
ChEBI Ontology
Outgoing Relation(s)
5-deoxy-5-aminoshikimic acid zwitterion (CHEBI:194198) has functional parent shikimate (CHEBI:36208)
5-deoxy-5-aminoshikimic acid zwitterion (CHEBI:194198) is a cyclohexenecarboxylate (CHEBI:36126)
5-deoxy-5-aminoshikimic acid zwitterion (CHEBI:194198) is a zwitterion (CHEBI:27369)
5-deoxy-5-aminoshikimic acid zwitterion (CHEBI:194198) is tautomer of 5-Deoxy-5-aminoshikimic acid (CHEBI:29490)
Incoming Relation(s)
5-Deoxy-5-aminoshikimic acid (CHEBI:29490) is tautomer of 5-deoxy-5-aminoshikimic acid zwitterion (CHEBI:194198)
Synonym  Source
5-aminoshikimateSUBMITTER
UniProt Name  Source
5-amino-5-deoxyshikimateUniProt
Manual XrefsDatabases
CPD-21874MetaCyc
Citations