CHEBI:57841 - 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−)

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ChEBI Name 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−)
ChEBI ID CHEBI:57841
ChEBI ASCII Name 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3-)
Definition Trianion of 4-amino-2-methyl-5-diphosphooxymethylpyrimidine arising from deprotonation of the diphosphate OH groups; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C6H8N3O7P2
Net Charge -3
Average Mass 296.09110
Monoisotopic Mass 295.984
InChI InChI=1S/C6H11N3O7P2/c1-4-8-2-5(6(7)9-4)3-15-18(13,14)16-17(10,11)12/h2H,3H2,1H3,(H,13,14)(H2,7,8,9)(H2,10,11,12)/p-3
InChIKey AGQJQCFEPUVXNK-UHFFFAOYSA-K
SMILES Cc1ncc(COP([O-])(=O)OP([O-])([O-])=O)c(N)n1
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−) (CHEBI:57841) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−) (CHEBI:57841) is a organophosphate oxoanion (CHEBI:58945)
4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−) (CHEBI:57841) is conjugate base of 4-amino-2-methyl-5-diphosphooxymethylpyrimidine (CHEBI:16629)
Incoming 4-amino-2-methyl-5-diphosphooxymethylpyrimidine (CHEBI:16629) is conjugate acid of 4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3−) (CHEBI:57841)
IUPAC Name
(4-amino-2-methylpyrimidin-5-yl)methyl diphosphate
Synonyms Sources
4-amino-2-methyl-5-(diphosphonooxymethyl)pyrimidine UniProt
4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine trianion ChEBI
Registry Number Type Source
7229943 Beilstein Registry Number Beilstein
Last Modified
04 February 2016