CHEBI:17422 - P1,P4-bis(5'-adenosyl) tetraphosphate

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ChEBI Name P1,P4-bis(5'-adenosyl) tetraphosphate
ChEBI ID CHEBI:17422
ChEBI ASCII Name P(1),P(4)-bis(5'-adenosyl) tetraphosphate
Definition A diadenosyl tetraphosphate compound having the two 5'-adenosyl residues attached at the P1- and P4-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:7875, CHEBI:21998, CHEBI:12726, CHEBI:12729
Supplier Information
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Formula C20H28N10O19P4
Net Charge 0
Average Mass 836.38736
Monoisotopic Mass 836.048
InChI InChI=1S/C20H28N10O19P4/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(45-19)1-43-50(35,36)47-52(39,40)49-53(41,42)48-51(37,38)44-2-8-12(32)14(34)20(46-8)30-6-28-10-16(22)24-4-26-18(10)30/h3-8,11-14,19-20,31-34H,1-2H2,(H,35,36)(H,37,38)(H,39,40)(H,41,42)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
InChIKey YOAHKNVSNCMZGQ-XPWFQUROSA-N
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)[C@@H](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 P1,P4-bis(5'-adenosyl) tetraphosphate (CHEBI:17422) has role Escherichia coli metabolite (CHEBI:76971)
P1,P4-bis(5'-adenosyl) tetraphosphate (CHEBI:17422) has role mouse metabolite (CHEBI:75771)
P1,P4-bis(5'-adenosyl) tetraphosphate (CHEBI:17422) is a diadenosyl tetraphosphate (CHEBI:63738)
P1,P4-bis(5'-adenosyl) tetraphosphate (CHEBI:17422) is conjugate acid of P1,P4-bis(5'-adenosyl) tetraphosphate(4−) (CHEBI:58141)
Incoming P1,P4-bis(5'-adenosyl) tetraphosphate(4−) (CHEBI:58141) is conjugate base of P1,P4-bis(5'-adenosyl) tetraphosphate (CHEBI:17422)
IUPAC Name
adenosine(5')tetraphospho(5')adenosine
Synonyms Sources
(ppA)2 CBN
A(5')p4(5')A CBN
AppppA KEGG COMPOUND
bis(5'-adenylyl) diphosphate CBN
P1,P4-Bis(5'-adenosyl) tetraphosphate KEGG COMPOUND
Manual Xrefs Databases
B4P PDBeChem
C01260 KEGG COMPOUND
View more database links
Last Modified
27 January 2016