CHEBI:17985 - adenosine 3',5'-bismonophosphate

ChEBI IDCHEBI:17985
ChEBI Nameadenosine 3',5'-bismonophosphate
Stars
DefinitionAn adenosine bisphosphate having two monophosphate groups at the 3'- and 5'-positions.
Secondary ChEBI IDsCHEBI:2475, CHEBI:13735, CHEBI:22240
Last Modified27 January 2016
DownloadsMolfile
FormulaC10H15N5O10P2
Net Charge0
Average Mass427.203
Monoisotopic Mass427.02941
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](OP(=O)(O)O)[C@H]1O
InChIInChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(25-27(20,21)22)4(24-10)1-23-26(17,18)19/h2-4,6-7,10,16H,1H2,(H2,11,12,13)(H2,17,18,19)(H2,20,21,22)/t4-,6-,7-,10-/m1/s1
InChIKeyWHTCPDAXWFLDIH-KQYNXXCUSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
adenosine 3',5'-bismonophosphate (CHEBI:17985) has role Escherichia coli metabolite (CHEBI:76971)
adenosine 3',5'-bismonophosphate (CHEBI:17985) has role mouse metabolite (CHEBI:75771)
adenosine 3',5'-bismonophosphate (CHEBI:17985) is a adenosine bisphosphate (CHEBI:22251)
adenosine 3',5'-bismonophosphate (CHEBI:17985) is conjugate acid of adenosine 3',5'-bismonophosphate(4−) (CHEBI:58343)
Incoming Relation(s)
3'-phospho-5'-adenylyl sulfate (CHEBI:17980) has functional parent adenosine 3',5'-bismonophosphate (CHEBI:17985)
adenosine 3',5'-bismonophosphate(4−) (CHEBI:58343) is conjugate base of adenosine 3',5'-bismonophosphate (CHEBI:17985)
IUPAC Name 
adenosine 3',5'-bis(dihydrogen phosphate)
Synonyms  Source
3'-phosphoadenylateChEBI
3'-PhosphoadenylateKEGG COMPOUND
Adenosine 3',5'-bisphosphateKEGG COMPOUND
PAPKEGG COMPOUND
Phosphoadenosine phosphateKEGG COMPOUND
Manual XrefsDatabases
A3PPDBeChem
C00019352KNApSAcK
C00054KEGG COMPOUND
C00054KEGG COMPOUND
Registry NumbersSources
CAS:1053-73-2KEGG COMPOUND