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
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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MetaCyc Compound: 2'-deoxycoformycin

Synonyms: pentostatin, deoxycoformycin, Covidarabine, Oncopent, Vidarbine, Coforin, Nipent (TN)

Chemical Formula: C11H17N4O4

Molecular Weight: 269.28 Daltons

Monoisotopic Molecular Weight: 268.1171550228 Daltons

SMILES: C1(C(C(CO)OC1N3(C=NC2(C(CNC=[N+]C=23)O)))O)

InChI: InChI=1S/C11H16N4O4/c16-3-8-6(17)1-9(19-8)15-5-14-10-7(18)2-12-4-13-11(10)15/h4-9,16-18H,1-3H2,(H,12,13)/p+1/t6-,7+,8+,9+/m0/s1

InChIKey: InChIKey=FPVKHBSQESCIEP-JQCXWYLXSA-O

Unification Links: ChEBI:553578 , HMDB:HMDB14692 , KEGG:C02267 , PubChem:54758585

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): 104.146996 Inferred by computational analysis [Latendresse13]

Enzymes inhibited by 2'-deoxycoformycin, sorted by the type of inhibition, are:

Inhibitor (Mechanism unknown) of: adenine deaminase [Downie08] , adenosine deaminase [IwakiEgawa02]

Credits:
Created 20-Oct-2009 by Fulcher CA , SRI International


References

Downie08: Downie MJ, Kirk K, Mamoun CB (2008). "Purine salvage pathways in the intraerythrocytic malaria parasite Plasmodium falciparum." Eukaryot Cell 7(8);1231-7. PMID: 18567789

IwakiEgawa02: Iwaki-Egawa S, Watanabe Y (2002). "Characterization and purification of adenosine deaminase 1 from human and chicken liver." Comp Biochem Physiol B Biochem Mol Biol 133(2);173-82. PMID: 12381379

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 Fri Nov 28, 2014, BIOCYC14B.