CHEBI:28898 - P¹,P⁵-bis(5'-adenosyl) pentaphosphate

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ChEBI Name P1,P5-bis(5'-adenosyl) pentaphosphate ChEBI ID CHEBI:28898 ChEBI ASCII Name P(1),P(5)-bis(5'-adenosyl) pentaphosphate Definition A diadenosyl pentaphosphate having the two 5'-adenosyl residues attached at the P1- and P5-positions. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:22002, CHEBI:3120 Supplier Information ZINC000096085195 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C20H29N10O22P5 Net Charge 0 Average Mass 916.36690 Monoisotopic Mass 916.01460 InChI InChI=1S/C20H29N10O22P5/c21-15-9-17(25-3-23-15)29(5-27-9)19-13(33)11(31)7(47-19)1-45-53(35,36)49-55(39,40)51-57(43,44)52-56(41,42)50-54(37,38)46-2-8-12(32)14(34)20(48-8)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)(H,43,44)(H2,21,23,25)(H2,22,24,26)/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1 InChIKey OIMACDRJUANHTJ-XPWFQUROSA-N SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(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 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. Application(s): vasoconstrictor agent Drug used to cause constriction of the blood vessels. View more via ChEBI Ontology ChEBI Ontology Outgoing P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) has role Escherichia coli metabolite (CHEBI:76971) P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) has role vasoconstrictor agent (CHEBI:50514) P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) is a diadenosyl pentaphosphate (CHEBI:63737) P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) is conjugate acid of P1,P5-bis(5'-adenosyl) pentaphosphate(5−) (CHEBI:62041) Incoming P1,P5-bis(5'-adenosyl) pentaphosphate(5−) (CHEBI:62041) is conjugate base of P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) IUPAC Name adenosine(5')pentaphospho(5')adenosine Synonyms Sources Bis(5'-adenosyl) pentaphosphate KEGG COMPOUND P(1),P(5)-Di(adenosine-5'-)pentaphosphate ChemIDplus P1,P5-Bis(5'-adenosyl) pentaphosphate KEGG COMPOUND Manual Xrefs Databases AP5 PDBeChem C04058 KEGG COMPOUND View more database links Registry Numbers Types Sources 50304-44-4 CAS Registry Number ChemIDplus 604343 Beilstein Registry Number Beilstein Last Modified 25 January 2016