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CHEBI:137396 - 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate

ChEBI IDCHEBI:137396
ChEBI Name5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate
Stars
ASCII Name5-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium-3-carbonyl adenylate
DefinitionAn acyclic mixed acid anhydride obtained by condensation of one of the carboxy group of pyridinium-3,5-biscarboxylic acid mononucleotide with the phosphste group of AMP.
Last Modified12 June 2017
SubmitterSteve
DownloadsMolfile
FormulaC22H27N6O17P2
Net Charge+1
Average Mass709.431
Monoisotopic Mass709.09024
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OC(=O)c2cc(C(=O)O)c[n+]([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c2)[C@@H](O)[C@H]1O
InChIInChI=1S/C22H26N6O17P2/c23-17-12-18(25-6-24-17)28(7-26-12)20-16(32)14(30)11(44-20)5-42-47(39,40)45-22(35)9-1-8(21(33)34)2-27(3-9)19-15(31)13(29)10(43-19)4-41-46(36,37)38/h1-3,6-7,10-11,13-16,19-20,29-32H,4-5H2,(H5-,23,24,25,33,34,36,37,38,39,40)/p+1/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1
InChIKeyXFGNNUKNRVMPRK-HISDBWNOSA-O
ChEBI Ontology
Outgoing Relation(s)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) has functional parent adenosine 5'-monophosphate (CHEBI:16027)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) has functional parent pyridinium-3,5-biscarboxylic acid mononucleotide (CHEBI:137395)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) is a acyclic mixed acid anhydride (CHEBI:37787)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) is a adenosine 5'-phosphate (CHEBI:37096)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) is a pyridine nucleotide (CHEBI:36980)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396) is conjugate acid of 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−) (CHEBI:137355)
Incoming Relation(s)
5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−) (CHEBI:137355) is conjugate base of 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate (CHEBI:137396)
Synonyms  Source
P2CMN-adenylateChEBI
pyridinium-3,5-biscarboxylate mononucleotide adenylateChEBI
Citations