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

Properties

Image

Occurences in reactions

MNX_ID

MNXM127136

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

formula

C₆H₈N₂O₄

charge

mass

172.04841

reference

InChIKey

BDHFFHBFJUZSBF-BYPYZUCNSA-N

InChI

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

SMILES

[NH3+][C@@H](Cn1ccc(=O)o1)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:76855 chebi:76855	3-(5-oxoisoxazolin-2-yl)-L-alanine (2S)-2-azaniumyl-3-(5-oxo-1,2-oxazol-2(5H)-yl)propanoate 3-(5-oxoisoxazolin-2-yl)-L-alanine zwitterion BIA beta-(isoxazolin-5-on-2-yl)-L-alanine
kegg.compound:C20892 keggC:C20892	3-(5-Oxoisoxazolin-2-yl)-L-alanine beta-(Isoxazolin-5-on-2-yl)-L-alanine
CHEBI:77029 chebi:77029	3-(5-oxoisoxazolin-2-yl)-L-alanine (Isoxazolin-5-on-2-yl)alanine (S)-alpha-Amino-5-oxo-2(5H)-isoxazolepropanoic acid 3-(5-oxo-1,2-oxazol-2(5H)-yl)-L-alanine BIOYA alpha-Amino-5-oxo-(S)-2(5H)-Isoxazolepropanoic acid beta-(Isoxazolin-5-on-2-yl)alanine beta-(isoxazolin-5-on-2-yl)-L-alanine
metacyc.compound:CPD-16449 metacycM:CPD-16449 seed.compound:cpd34363 seedM:cpd34363	3-(5-oxoisoxazolin-2-yl)-L-alanine beta-(isoxazolin-5-on-2-yl)-L-alanine
keggC:M_C20892 seedM:M_cpd34363	secondary/obsolete/fantasy identifier