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: adenosine pentaphosphate

Synonyms: adenosine 5'-pentaphosphate

Superclasses: a nucleic acid component a nucleotide a modified nucleotide

Chemical Formula: C10H13N5O19P5

Molecular Weight: 662.1 Daltons

Monoisotopic Molecular Weight: 666.9284059736999 Daltons

SMILES: C(C3(C(C(C(N2(C1(=C(C(=NC=N1)N)N=C2)))O3)O)O))OP(OP(=O)([O-])OP(=O)([O-])OP([O-])(=O)OP([O-])(=O)O)([O-])=O

InChI: InChI=1S/C10H18N5O19P5/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(30-10)1-29-36(21,22)32-38(25,26)34-39(27,28)33-37(23,24)31-35(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)(H2,11,12,13)(H2,18,19,20)/p-5/t4-,6-,7-,10-/m1/s1

InChIKey: InChIKey=WYJWVZZCMBUPSP-KQYNXXCUSA-I

Unification Links: ChEBI:40096 , HMDB:HMDB59647 , PubChem:46173396

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -816.586 Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

Not in pathways:
a nucleotide + H2O → a nucleoside + phosphate

In Reactions of unknown directionality:

Not in pathways:
5',5'''-diadenosine hexaphosphate + H2O = adenosine pentaphosphate + AMP + H+
adenosine pentaphosphate + H2O = adenosine tetraphosphate + phosphate + H+


a nucleotide + a 2'-deoxynucleoside = a nucleoside + a 2'-deoxyribonucleoside 5'-monophosphate

Credits:
Created 03-Aug-2009 by Kothari A , SRI International


References

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, biocyc14.