Metabolic Modeling Tutorial
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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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MetaCyc Compound: α-D-ribose-1-methylphosphonate-5-triphosphate

Citations: [Kamat11]

Chemical Formula: C6H11O16P4

Molecular Weight: 463.04 Daltons

Monoisotopic Molecular Weight: 467.9388805072 Daltons

SMILES: CP([O-])(=O)OC1(C(C(C(O1)COP(OP(=O)([O-])OP(=O)([O-])[O-])([O-])=O)O)O)

InChI: InChI=1S/C6H16O16P4/c1-23(9,10)20-6-5(8)4(7)3(19-6)2-18-25(14,15)22-26(16,17)21-24(11,12)13/h3-8H,2H2,1H3,(H,9,10)(H,14,15)(H,16,17)(H2,11,12,13)/p-5/t3-,4-,5-,6-/m1/s1

InChIKey: InChIKey=UXNHAIRVTPGNPL-KVTDHHQDSA-I

Unification Links: ChEBI:68823 , PubChem:70678977

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -778.6892 Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

methylphosphonate degradation I , methylphosphonate degradation II :
α-D-ribose-1-methylphosphonate-5-triphosphate + H2O → α-D-ribose-1-methylphosphonate 5-phosphate + diphosphate + H+

Reactions known to produce the compound:

methylphosphonate degradation I , methylphosphonate degradation II :
methylphosphonate + ATP → α-D-ribose-1-methylphosphonate-5-triphosphate + adenine

Credits:
Created in EcoCyc 22-Nov-2011 by Keseler I , SRI International
Imported from EcoCyc 20-Dec-2011 by Keseler I , SRI International


References

Kamat11: Kamat SS, Williams HJ, Raushel FM (2011). "Intermediates in the transformation of phosphonates to phosphate by bacteria." Nature 480(7378);570-3. PMID: 22089136

Latendresse13: Latendresse M. (2013). "Computing Gibbs Free Energy of Compounds and Reactions in MetaCyc."


Report Errors or Provide Feedback
Please cite the following article in publications resulting from the use of MetaCyc: Caspi et al, Nucleic Acids Research 42:D459-D471 2014
Page generated by SRI International Pathway Tools version 18.5 on Sun Nov 23, 2014, BIOCYC13B.