3-(5-oxoisoxazolin-2-yl)-L-alanine

3-(5-oxoisoxazolin-2-yl)-L-alanine




Chemical Formula:
C6H8N2O4
Molecular Weight:
172.14 Daltons
Monoisotopic Mass:
173.0562317877 Daltons
SMILES:
C1(=O)(ON(CC(C([O-])=O)[N+])C=C1)
InChI:
1S/C6H8N2O4/c7-4(6(10)11)3-8-2-1-5(9)12-8/h1-2,4H,3,7H2,(H,10,11)/t4-/m0/s1
InChIKey:
BDHFFHBFJUZSBF-BYPYZUCNSA-N

Synonyms
  • β-(isoxazolin-5-on-2-yl)-L-alanine

Databases
MetaCyc:  CPD-16449
ChEBI:  76855
PubChem (CID):  72715807
MetaboLights:  MTBLC77029
MetaNetX:  MNXM127136
KEGG:  C20892