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Concept information

... > chemical entity > molecular entity > ion > anion > organic anion > organophosphate oxoanion > pyridinium-3,5-biscarboxylate mononucleotide(3-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > organophosphate oxoanion > pyridinium-3,5-biscarboxylate mononucleotide(3-)
... > chemical entity > molecular entity > ion > anion > polyatomic anion > oxoanion > carboxylic acid anion > dicarboxylic acid anion > pyridinium-3,5-biscarboxylate mononucleotide(3-)
... > chemical entity > molecular entity > ion > anion > organic anion > carboxylic acid anion > dicarboxylic acid anion > pyridinium-3,5-biscarboxylate mononucleotide(3-)
... > chemical entity > molecular entity > ion > organic ion > organic anion > carboxylic acid anion > dicarboxylic acid anion > pyridinium-3,5-biscarboxylate mononucleotide(3-)

Preferred term

pyridinium-3,5-biscarboxylate mononucleotide(3-)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • -3

formula

  • C12H11NO11P

inchi

  • InChI=1S/C12H14NO11P/c14-8-7(4-23-25(20,21)22)24-10(9(8)15)13-2-5(11(16)17)1-6(3-13)12(18)19/h1-3,7-10,14-15H,4H2,(H3-,16,17,18,19,20,21,22)/p-3/t7-,8-,9-,10-/m1/s1

inchikey

  • QZWRRRIWSQHKCZ-ZYUZMQFOSA-K

mass

  • 376.190

monoisotopicmass

  • 376.00862

smiles

  • O(C[C@H]1O[C@@H]([N+]2=CC(=CC(=C2)C([O-])=O)C(=O)[O-])[C@@H]([C@@H]1O)O)P([O-])(=O)[O-]

subset

  • 3_STAR

synonym EXACT

  • 1-(5-O-phosphonato-beta-D-ribofuranosyl)pyridin-1-ium-3,5-dicarboxylate

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:137353

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