EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:59767 - N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine

ChEBI IDCHEBI:59767
ChEBI NameN6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine
Stars
ASCII NameN(6)-acetyl-N(2)-(5'-phosphopyridoxyl)-L-lysine
DefinitionA N6-acyl-L-lysine arising from reductive N-alkylation of N6-acetyl-L-lysine by pyridoxal-5-phosphate.
Last Modified16 December 2014
SubmitterSteve
DownloadsMolfile
FormulaC16H26N3O8P
Net Charge0
Average Mass419.371
Monoisotopic Mass419.14575
SMILESCC(=O)NCCCC[C@H](NCc1c(COP(=O)(O)O)cnc(C)c1O)C(=O)O
InChIInChI=1S/C16H26N3O8P/c1-10-15(21)13(12(7-18-10)9-27-28(24,25)26)8-19-14(16(22)23)5-3-4-6-17-11(2)20/h7,14,19,21H,3-6,8-9H2,1-2H3,(H,17,20)(H,22,23)(H2,24,25,26)/t14-/m0/s1
InChIKeyZQGOSPTVQVGUON-AWEZNQCLSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
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.
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) has functional parent pyridoxal (CHEBI:17310)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) has role antigen (CHEBI:59132)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) has role epitope (CHEBI:53000)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) is a N6-acyl-L-lysine (CHEBI:16232)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) is a organic phosphate (CHEBI:25703)
N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) is conjugate acid of N6-acetyl-N2-(5'-phosphonatopyridoxyl)-L-lysinate(2−) (CHEBI:59766)
Incoming Relation(s)
N6-acetyl-N2-(5'-phosphonatopyridoxyl)-L-lysinate(2−) (CHEBI:59766) is conjugate base of N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767)
IUPAC Name 
N6-acetyl-N2-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-L-lysine
Synonym  Source
Nε-acetyl-Nα-(5'-phosphopyridoxyl)-L-lysineChEBI
Citations