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: 8-oxo-dGMP

Synonyms: 8-oxo-7,8-dihydro-2'-dGMP, 8-oxo-7,8-dihydro-2'-deoxyguanosine 5'-monophosphate, 8-oxo-deoxyguanosine-monophosphate

Superclasses: a nucleic acid component

Citations: [Maki92]

Chemical Formula: C10H12N5O8P

Molecular Weight: 361.21 Daltons

Monoisotopic Molecular Weight: 363.0579989622 Daltons

SMILES: C(OP(=O)([O-])[O-])C1(OC(CC(O)1)N3(C(=O)NC2(C(=O)NC(N)=NC=23)))

InChI: InChI=1S/C10H14N5O8P/c11-9-13-7-6(8(17)14-9)12-10(18)15(7)5-1-3(16)4(23-5)2-22-24(19,20)21/h3-5,16H,1-2H2,(H,12,18)(H2,19,20,21)(H3,11,13,14,17)/p-2/t3-,4+,5+/m0/s1

InChIKey: InChIKey=AQIVLFLYHYFRKU-VPENINKCSA-L

Unification Links: ChEBI:63224 , PubChem:46173535

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -251.7538 Inferred by computational analysis [Latendresse13]

Reactions known to produce the compound:

oxidized GTP and dGTP detoxification :
8-oxo-dGTP + H2O → 8-oxo-dGMP + diphosphate + H+

Not in pathways:
8-oxo-dGDP + H2O → 8-oxo-dGMP + phosphate + H+

In Reactions of unknown directionality:

Not in pathways:
8-oxo-dGTP + 2 H2O = 8-oxo-dGMP + 2 phosphate + 2 H+

Credits:
Created 21-Apr-2010 by Dreher KA , TAIR


References

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

Maki92: Maki H, Sekiguchi M (1992). "MutT protein specifically hydrolyses a potent mutagenic substrate for DNA synthesis." Nature 355(6357);273-5. PMID: 1309939


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 Wed Nov 26, 2014, BIOCYC13B.