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CHEBI:62041 - P1,P5-bis(5'-adenosyl) pentaphosphate(5−)

ChEBI IDCHEBI:62041
ChEBI NameP1,P5-bis(5'-adenosyl) pentaphosphate(5−)
Stars
ASCII NameP(1),P(5)-bis(5'-adenosyl) pentaphosphate(5-)
DefinitionAn organophosphate oxoanion arising from global deprotonation of the pentaphosphate OH groups of P1,P5-bis(5'-adenosyl) pentaphosphate.
Last Modified17 March 2019
SubmitterEugeni Belda
DownloadsMolfile
FormulaC20H24N10O22P5
Net Charge-5
Average Mass911.330
Monoisotopic Mass910.97821
SMILESNc1ncnc2c1ncn2[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](n3cnc4c(N)ncnc43)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O
InChIInChI=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)/p-5/t7-,8-,11-,12-,13-,14-,19-,20-/m1/s1
InChIKeyOIMACDRJUANHTJ-XPWFQUROSA-I
ChEBI Ontology
Outgoing Relation(s)
P1,P5-bis(5'-adenosyl) pentaphosphate(5−) (CHEBI:62041) is a organophosphate oxoanion (CHEBI:58945)
P1,P5-bis(5'-adenosyl) pentaphosphate(5−) (CHEBI:62041) is conjugate base of P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898)
Incoming Relation(s)
P1,P5-bis(5'-adenosyl) pentaphosphate (CHEBI:28898) is conjugate acid of P1,P5-bis(5'-adenosyl) pentaphosphate(5−) (CHEBI:62041)
Synonyms  Source
P(1),P(5)-di(adenosine-5'-)pentaphosphate(5−)SUBMITTER
Ap5ASUBMITTER
P1,P5-di(adenosine-5')-pentaphosphate(5−)SUBMITTER
adenosine(5')pentaphosphonato(5')adenosine(5−)ChEBI
UniProt Name  Source
P1,P5-bis(5'-adenosyl) pentaphosphateUniProt
Manual XrefsDatabases
CPD0-1137MetaCyc
Registry NumbersSources
Reaxys:5230559Reaxys
Citations