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CHEBI:57464 - 5'-xanthylate(2−)

ChEBI IDCHEBI:57464
ChEBI Name5'-xanthylate(2−)
Stars
ASCII Name5'-xanthylate(2-)
DefinitionA nucleoside 5'-monophosphate(2−) that results from the removal of two protons from the phosphate group of 5'-xanthylic acid; major species at pH 7.3.
Last Modified8 March 2017
DownloadsMolfile
FormulaC10H11N4O9P
Net Charge-2
Average Mass362.191
Monoisotopic Mass362.02746
SMILESO=c1nc(=O)c2ncn([C@@H]3O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]3O)c2n1
InChIInChI=1S/C10H13N4O9P/c15-5-3(1-22-24(19,20)21)23-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H2,19,20,21)(H2,12,13,17,18)/p-2/t3-,5-,6-,9-/m1/s1
InChIKeyDCTLYFZHFGENCW-UUOKFMHZSA-L
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
5'-xanthylate(2−) (CHEBI:57464) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
5'-xanthylate(2−) (CHEBI:57464) has role human metabolite (CHEBI:77746)
5'-xanthylate(2−) (CHEBI:57464) is a nucleoside 5'-monophosphate(2−) (CHEBI:58043)
5'-xanthylate(2−) (CHEBI:57464) is conjugate base of 5'-xanthylic acid (CHEBI:15652)
Incoming Relation(s)
5'-xanthylic acid (CHEBI:15652) is conjugate acid of 5'-xanthylate(2−) (CHEBI:57464)
IUPAC Name 
5'-O-phosphonatoxanthosine
Synonym  Source
5'-xanthylate dianionChEBI
UniProt Name  Source
XMPUniProt
Registry NumbersSources
Beilstein:11352170Beilstein
Gmelin:1082168Gmelin