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CHEBI:59566 - N-[4-(4-nitrophenylphospho)butanoyl]alanine

ChEBI IDCHEBI:59566
ChEBI NameN-[4-(4-nitrophenylphospho)butanoyl]alanine
Stars
ASCII NameN-[4-(4-nitrophenylphospho)butanoyl]alanine
DefinitionAn alanine derivative having a 4-(4-nitrophenylphospho)butanoyl group attached to the nitrogen of alanine.
Last Modified28 February 2017
SubmitterSteve
DownloadsMolfile
FormulaC13H17N2O8P
Net Charge0
Average Mass360.259
Monoisotopic Mass360.07225
SMILESCC(NC(=O)CCCP(=O)(O)Oc1ccc([N+](=O)[O-])cc1)C(=O)O
InChIInChI=1S/C13H17N2O8P/c1-9(13(17)18)14-12(16)3-2-8-24(21,22)23-11-6-4-10(5-7-11)15(19)20/h4-7,9H,2-3,8H2,1H3,(H,14,16)(H,17,18)(H,21,22)
InChIKeyKBXXIYHMPQZHCH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N-[4-(4-nitrophenylphospho)butanoyl]alanine (CHEBI:59566) is a C-nitro compound (CHEBI:35716)
N-[4-(4-nitrophenylphospho)butanoyl]alanine (CHEBI:59566) is a alanine derivative (CHEBI:22278)
N-[4-(4-nitrophenylphospho)butanoyl]alanine (CHEBI:59566) is a aryl phosphonate (CHEBI:91046)
Incoming Relation(s)
N-[4-(4-nitrophenylphospho)butanoyl]-D-alanine (CHEBI:45002) is a N-[4-(4-nitrophenylphospho)butanoyl]alanine (CHEBI:59566)
N-[4-(4-nitrophenylphospho)butanoyl]-L-alanine (CHEBI:59565) is a N-[4-(4-nitrophenylphospho)butanoyl]alanine (CHEBI:59566)
IUPAC Name 
N-{4-[hydroxy(4-nitrophenoxy)phosphoryl]butanoyl}alanine
Synonym  Source
N-[4-[hydroxy(4-nitrophenoxy)phosphinyl]-1-oxobutyl]alanineChEBI