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CHEBI:58978 - 3-(phenyldiazenyl)-AcTyrGlyGly

ChEBI IDCHEBI:58978
ChEBI Name3-(phenyldiazenyl)-AcTyrGlyGly
Stars
DefinitionA tripeptide consisting of AcTyrGlyGly with a phenyldiazenyl substituent at the 3-position on the tyrosine phenyl ring.
Last Modified26 February 2010
Submitterzjosephs
DownloadsMolfile
FormulaC21H23N5O6
Net Charge0
Average Mass441.444
Monoisotopic Mass441.16483
SMILESCC(=O)N[C@@H](Cc1ccc(O)c(/N=N/c2ccccc2)c1)C(=O)NCC(=O)NCC(=O)O
InChIInChI=1S/C21H23N5O6/c1-13(27)24-17(21(32)23-11-19(29)22-12-20(30)31)10-14-7-8-18(28)16(9-14)26-25-15-5-3-2-4-6-15/h2-9,17,28H,10-12H2,1H3,(H,22,29)(H,23,32)(H,24,27)(H,30,31)/b26-25+/t17-/m0/s1
InChIKeyMXDGNHKDBUFLCE-OTXPQFFASA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
3-(phenyldiazenyl)-AcTyrGlyGly (CHEBI:58978) is a monoazo compound (CHEBI:48959)
3-(phenyldiazenyl)-AcTyrGlyGly (CHEBI:58978) is a tripeptide (CHEBI:47923)
IUPAC Name 
N-acetyl-3-[(E)-phenyldiazenyl]-L-tyrosylglycylglycine
Synonym  Source
3-(phenylazo)-N-acetyl-L-tyrosylglycylglycineChEBI
Citations