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CHEBI:91806 - 2-amino-3-(5-tert-butyl-3-oxo-4-isoxazolyl)propanoic acid

ChEBI IDCHEBI:91806
ChEBI Name2-amino-3-(5-tert-butyl-3-oxo-4-isoxazolyl)propanoic acid
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DownloadsMolfile
FormulaC10H16N2O4
Net Charge0
Average Mass228.248
Monoisotopic Mass228.11101
SMILESCC(C)(C)c1onc(=O)c1CC(N)C(=O)O
InChIInChI=1S/C10H16N2O4/c1-10(2,3)7-5(8(13)12-16-7)4-6(11)9(14)15/h6H,4,11H2,1-3H3,(H,12,13)(H,14,15)
InChIKeyPIXJURSCCVBKRF-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
2-amino-3-(5-tert-butyl-3-oxo-4-isoxazolyl)propanoic acid (CHEBI:91806) is a α-amino acid (CHEBI:33704)
Manual XrefsDatabases
LSM-1708LINCS