CHEBI:76856 - 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion

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ChEBI Name 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion ChEBI ID CHEBI:76856 ChEBI ASCII Name 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion Definition An amino acid zwitterion resulting from a transfer of a proton from the carboxy group to the amino group of 3-(5-oxoisoxazolin-4-yl)-L-alanine; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H8N2O4 Net Charge 0 Average Mass 172.13870 Monoisotopic Mass 172.04841 InChI InChI=1S/C6H8N2O4/c7-4(5(9)10)1-3-2-8-12-6(3)11/h2,4,8H,1,7H2,(H,9,10)/t4-/m0/s1 InChIKey LVNJBTYSYFSYFG-BYPYZUCNSA-N SMILES [NH3+][C@@H](Cc1c[nH]oc1=O)C([O-])=O ChEBI Ontology Outgoing 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion (CHEBI:76856) is a amino acid zwitterion (CHEBI:35238) 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion (CHEBI:76856) is tautomer of 3-(5-oxoisoxazolin-4-yl)-L-alanine (CHEBI:77030) Incoming 3-(5-oxoisoxazolin-4-yl)-L-alanine (CHEBI:77030) is tautomer of 3-(5-oxoisoxazolin-4-yl)-L-alanine zwitterion (CHEBI:76856) IUPAC Name (2S)-2-azaniumyl-3-(5-oxo-2,5-dihydro-1,2-oxazol-4-yl)propanoate Synonyms Sources 3-(5-oxoisoxazolin-4-yl)-L-alanine UniProt β-(isoxazolin-5-on-4-yl)-L-alanine SUBMITTER Citation Type Source 8889043 PubMed citation SUBMITTER Last Modified 20 January 2014