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CHEBI:72482 - Dnp-Thr-Gln

ChEBI IDCHEBI:72482
ChEBI NameDnp-Thr-Gln
Stars
DefinitionA dipeptide consisting of L-threonine substituted on nitrogen by a 2,4-dinitrophenyl group and connected to L-glutamine via a peptide bond.
Last Modified21 February 2013
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC15H19N5O9
Net Charge0
Average Mass413.343
Monoisotopic Mass413.11828
SMILESCC(O)[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(=O)N[C@@H](CCC(N)=O)C(=O)O
InChIInChI=1S/C15H19N5O9/c1-7(21)13(14(23)18-10(15(24)25)4-5-12(16)22)17-9-3-2-8(19(26)27)6-11(9)20(28)29/h2-3,6-7,10,13,17,21H,4-5H2,1H3,(H2,16,22)(H,18,23)(H,24,25)/t7?,10-,13-/m0/s1
InChIKeySAHHOESMIODDOI-LSBDQBMESA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
epitope  The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
ChEBI Ontology
Outgoing Relation(s)
Dnp-Thr-Gln (CHEBI:72482) has part 2,4-dinitrophenyl group (CHEBI:53018)
Dnp-Thr-Gln (CHEBI:72482) has role epitope (CHEBI:53000)
Dnp-Thr-Gln (CHEBI:72482) is a dipeptide (CHEBI:46761)
IUPAC Name 
N-(2,4-dinitrophenyl)-L-threonyl-L-glutamine
Synonym  Source
DNP-ThrChEBI
Citations