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: 5-methyl-phenazine-1-carboxylate

Synonyms: 5-methyl-phenazine-1-carboxylic acid

Superclasses: a secondary metabolite

Citations: [Parsons07]

Chemical Formula: C14H10N2O2

Molecular Weight: 238.24 Daltons

Monoisotopic Molecular Weight: 239.0820526077 Daltons

SMILES: C[N+]1(=C3(C=CC=C(C(=NC2(C=CC=CC1=2))3)C(=O)[O-]))

InChI: InChI=1S/C14H10N2O2/c1-16-11-7-3-2-6-10(11)15-13-9(14(17)18)5-4-8-12(13)16/h2-8H,1H3

InChIKey: InChIKey=WBQUROCKWAJPFB-UHFFFAOYSA-N

Unification Links: ChEBI:62221 , PubChem:50986167

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): 97.32221 Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

pyocyanin biosynthesis :
5-methyl-phenazine-1-carboxylate + NADH + oxygen + 2 H+ → pyocyanin + CO2 + NAD+ + H2O

Reactions known to produce the compound:

pyocyanin biosynthesis :
phenazine-1-carboxylate + S-adenosyl-L-methionine → 5-methyl-phenazine-1-carboxylate + S-adenosyl-L-homocysteine

Credits:
Created 01-Dec-2010 by Fulcher CA , SRI International


References

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

Parsons07: Parsons JF, Greenhagen BT, Shi K, Calabrese K, Robinson H, Ladner JE (2007). "Structural and functional analysis of the pyocyanin biosynthetic protein PhzM from Pseudomonas aeruginosa." Biochemistry 46(7);1821-8. PMID: 17253782


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, biocyc13.