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This is an old revision of this page, as edited by Beetstra (talk | contribs) at 18:24, 16 February 2012 (Saving copy of the {{chembox}} taken from revid 443353874 of page 5'-Phosphoribosyl-4-carboxy-5-aminoimidazole for the Chem/Drugbox validation project (updated: 'CASNo').). The present address (URL) is a permanent link to this revision, which may differ significantly from the current revision.

Revision as of 18:24, 16 February 2012 by Beetstra (talk | contribs) (Saving copy of the {{chembox}} taken from revid 443353874 of page 5'-Phosphoribosyl-4-carboxy-5-aminoimidazole for the Chem/Drugbox validation project (updated: 'CASNo').)(diff) ← Previous revision | Latest revision (diff) | Newer revision → (diff)
This page contains a copy of the infobox ({{chembox}}) taken from revid 443353874 of page 5'-Phosphoribosyl-4-carboxy-5-aminoimidazole with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name 5-Amino-1-imidazole-4-carboxylic acid
Other names Carboxyaminoimidazole ribotide,
Carboxyaminoimidazole ribonucleotide,
CAIR,
5-amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazole-4-carboxylic acid
Identifiers
3D model (JSmol)
ChEBI
ChemSpider
PubChem CID
InChI
  • InChI=1S/C9H14N3O9P/c10-7-4(9(15)16)11-2-12(7)8-6(14)5(13)3(21-8)1-20-22(17,18)19/h2-3,5-6,8,13-14H,1,10H2,(H,15,16)(H2,17,18,19)/t3-,5-,6-,8-/m1/s1Key: XFVULMDJZXYMSG-ZIYNGMLESA-N
  • InChI=1/C9H14N3O9P/c10-7-4(9(15)16)11-2-12(7)8-6(14)5(13)3(21-8)1-20-22(17,18)19/h2-3,5-6,8,13-14H,1,10H2,(H,15,16)(H2,17,18,19)/t3-,5-,6-,8-/m1/s1Key: XFVULMDJZXYMSG-ZIYNGMLEBD
SMILES
  • C1=NC(=C(N12(((O2)COP(=O)(O)O)O)O)N)C(=O)O
  • O=P(O)(O)OC2O(n1cnc(C(=O)O)c1N)(O)2O
Properties
Chemical formula C9H14N3O9P
Molar mass 339.196 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkverify (what is  ?) Infobox references
Chemical compound
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