3-(5-oxoisoxazolin-4-yl)-L-alanine

3-(5-oxoisoxazolin-4-yl)-L-alanine




Chemical Formula:
C6H8N2O4
Molecular Weight:
172.14 Daltons
Monoisotopic Mass:
173.0562317877 Daltons
SMILES:
C([O-])(=O)C([N+])CC1(C(=O)ONC=1)
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

Synonyms
  • β-(isoxazolin-5-on-4-yl)-L-alanine
  • TAN-950A

Databases
MetaCyc:  CPD-16452
ChEBI:  76856
PubChem (CID):  72715787
MetaboLights:  MTBLC77030
MetaNetX:  MNXM146348
KEGG:  C20893