CHEBI:137355 - 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−)

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ChEBI Name 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−) ChEBI ID CHEBI:137355 ChEBI ASCII Name 5-carboxy-1-(5-O-phosphono-beta-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3-) Definition An organophosphate oxoanion obtained by deprotonation of the carboxy and phosphate OH groups of 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C22H23N6O17P2 Net Charge -3 Average Mass 705.396 Monoisotopic Mass 705.06114 InChI InChI=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-3/t10-,11-,13-,14-,15-,16-,19-,20-/m1/s1 InChIKey XFGNNUKNRVMPRK-HISDBWNOSA-K SMILES O(C[C@H]1O[C@@H]([N+]2=CC(=CC(=C2)C([O-])=O)C(=O)OP(OC[C@H]3O[C@@H](N4C=5N=CN=C(N)C5N=C4)[C@@H]([C@@H]3O)O)(=O)[O-])[C@@H]([C@@H]1O)O)P([O-])(=O)[O-] ChEBI Ontology Outgoing 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−) (CHEBI:137355) is a monocarboxylic acid anion (CHEBI:35757) 5-carboxy-1-(5-O-phosphono-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate(3−) (CHEBI:137355) is a organophosphate oxoanion (CHEBI:58945) 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) Incoming 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) Synonyms Sources 5-carboxy-1-(5-O-phospho-β-D-ribofuranosyl)pyridinium-3-carbonyl adenylate UniProt P2CMN-adenylate(3−) ChEBI pyridinium-3,5-biscarboxylate mononucleotide adenylate(3−) ChEBI Citation Type Source 27114550 PubMed citation SUBMITTER Last Modified 19 June 2017