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

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name adenosine 3',5'-bismonophosphate
ChEBI ID CHEBI:17985
Definition An adenosine bisphosphate having two monophosphate groups at the 3'- and 5'-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:2475, CHEBI:13735, CHEBI:22240
Supplier Information ChemicalBook:CB5853720, ChemicalBook:CB82551184, eMolecules:532436, Selleckchem:l-thyroxine, ZINC000003830993
Download Molfile XML SDF
Formula C10H15N5O10P2
Net Charge 0
Average Mass 427.20132
Monoisotopic Mass 427.02942
InChI InChI=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
InChIKey WHTCPDAXWFLDIH-KQYNXXCUSA-N
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H]1O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:txid562) See: PubMed
Roles Classification
Biological Role(s): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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 Sources
3'-phosphoadenylate ChEBI
3'-Phosphoadenylate KEGG COMPOUND
Adenosine 3',5'-bisphosphate KEGG COMPOUND
PAP KEGG COMPOUND
Phosphoadenosine phosphate KEGG COMPOUND
Manual Xrefs Databases
A3P PDBeChem
C00019352 KNApSAcK
C00054 KEGG COMPOUND
View more database links
Registry Number Type Source
1053-73-2 CAS Registry Number KEGG COMPOUND
Last Modified
27 January 2016