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CHEBI:58979 - 3-[(4-carboxyphenyl)diazenyl]-N-AcTyrGlyGly

ChEBI IDCHEBI:58979
ChEBI Name3-[(4-carboxyphenyl)diazenyl]-N-AcTyrGlyGly
Stars
ASCII Name3-[(4-carboxyphenyl)diazenyl]-N-AcTyrGlyGly
DefinitionA tripeptide consisting of AcTyrGlyGly with a (p-carboxyphenyl)diazenyl substituent at the 3-position on the tyrosine phenyl ring.
Last Modified26 February 2010
Submitterzjosephs
DownloadsMolfile
FormulaC22H23N5O8
Net Charge0
Average Mass485.453
Monoisotopic Mass485.15466
SMILESCC(=O)N[C@@H](Cc1ccc(O)c(/N=N/c2ccc(C(=O)O)cc2)c1)C(=O)NCC(=O)NCC(=O)O
InChIInChI=1S/C22H23N5O8/c1-12(28)25-17(21(33)24-10-19(30)23-11-20(31)32)9-13-2-7-18(29)16(8-13)27-26-15-5-3-14(4-6-15)22(34)35/h2-8,17,29H,9-11H2,1H3,(H,23,30)(H,24,33)(H,25,28)(H,31,32)(H,34,35)/b27-26+/t17-/m0/s1
InChIKeyLLGJFVUWWWCPKB-QUNNOBFSSA-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-[(4-carboxyphenyl)diazenyl]-N-AcTyrGlyGly (CHEBI:58979) is a monoazo compound (CHEBI:48959)
3-[(4-carboxyphenyl)diazenyl]-N-AcTyrGlyGly (CHEBI:58979) is a tripeptide (CHEBI:47923)
IUPAC Name 
N-acetyl-3-[(E)-(4-carboxyphenyl)diazenyl]-L-tyrosylglycylglycine
Synonyms  Source
3-(p-carboxyphenylazo)-N-acetyl-L-YGGChEBI
3-(p-carboxyphenylazo)-N-acetyl-L-tyrosylglycylglycineChEBI
Citations