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CHEBI:28450 - 3'-phosphoadenylyl selenate

ChEBI IDCHEBI:28450
ChEBI Name3'-phosphoadenylyl selenate
Stars
DefinitionAn organoselenium compound that is adenylyl selenate with the hydroxy at position 3' replaced by a phosphate group.
Secondary ChEBI IDsCHEBI:1354, CHEBI:19856
Last Modified27 January 2016
DownloadsMolfile
FormulaC10H15N5O13P2Se
Net Charge0
Average Mass554.160
Monoisotopic Mass554.93068
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O[Se](=O)(=O)O)[C@@H](OP(=O)(O)O)[C@H]1O
InChIInChI=1S/C10H15N5O13P2Se/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(27-29(17,18)19)4(26-10)1-25-30(20,21)28-31(22,23)24/h2-4,6-7,10,16H,1H2,(H,20,21)(H2,11,12,13)(H2,17,18,19)(H,22,23,24)/t4-,6-,7-,10-/m1/s1
InChIKeyAZRLZPIFEZUZLW-KQYNXXCUSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
3'-phosphoadenylyl selenate (CHEBI:28450) has functional parent adenosine (CHEBI:16335)
3'-phosphoadenylyl selenate (CHEBI:28450) has role mouse metabolite (CHEBI:75771)
3'-phosphoadenylyl selenate (CHEBI:28450) is a adenosine bisphosphate (CHEBI:22251)
3'-phosphoadenylyl selenate (CHEBI:28450) is a organoselenium compound (CHEBI:25712)
IUPAC Name 
5'-O-[hydroxy(selenonooxy)phosphoryl]adenosine 3'-(dihydrogen phosphate)
Synonyms  Source
3'-PhosphoadenylylselenateKEGG COMPOUND
3'-Phosphoadenosine-5'-phosphoselanateKEGG COMPOUND
3-PhosphoadenylylselenateHMDB
3'-Phosphoadenosine-5'-phosphoselenateKEGG COMPOUND
Manual XrefsDatabases
C05696KEGG COMPOUND
HMDB0011104HMDB