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CHEBI:28275 - 3,5-dinitro-L-tyrosine

ChEBI IDCHEBI:28275
ChEBI Name3,5-dinitro-L-tyrosine
Stars
ASCII Name3,5-dinitro-L-tyrosine
DefinitionA non-proteinogenic L-α-amino acid that is L-tyrosine substituted by nitro groups at positions 3 and 5.
Secondary ChEBI IDsCHEBI:1408, CHEBI:19911
Last Modified17 December 2014
DownloadsMolfile
FormulaC9H9N3O7
Net Charge0
Average Mass271.185
Monoisotopic Mass271.04405
SMILESN[C@@H](Cc1cc([N+](=O)[O-])c(O)c([N+](=O)[O-])c1)C(=O)O
InChIInChI=1S/C9H9N3O7/c10-5(9(14)15)1-4-2-6(11(16)17)8(13)7(3-4)12(18)19/h2-3,5,13H,1,10H2,(H,14,15)/t5-/m0/s1
InChIKeySAZOSDSFLRXREA-YFKPBYRVSA-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)
3,5-dinitro-L-tyrosine (CHEBI:28275) is a C-nitro compound (CHEBI:35716)
3,5-dinitro-L-tyrosine (CHEBI:28275) is a L-tyrosine derivative (CHEBI:27177)
3,5-dinitro-L-tyrosine (CHEBI:28275) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
IUPAC Name 
3,5-dinitro-L-tyrosine
Synonyms  Source
3,5-Dinitro-L-tyrosineKEGG COMPOUND
(2S)-2-amino-3-(4-hydroxy-3,5-dinitrophenyl)propanoic acidIUPAC
Manual XrefsDatabases
C03225KEGG COMPOUND
Registry NumbersSources
Beilstein:3221783Beilstein
CAS:17360-11-1KEGG COMPOUND
CAS:18386-16-8ChemIDplus