Metabolic Modeling Tutorial
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Metabolic Modeling Tutorial
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ends Feb 21th, 2015
Metabolic Modeling Tutorial
early discounted registration
ends Feb 21th, 2015
Metabolic Modeling Tutorial
early discounted registration
ends Feb 21th, 2015
Metabolic Modeling Tutorial
early discounted registration
ends Feb 21th, 2015
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MetaCyc Compound: valienone 7-phosphate

Summary:
The stereochemical representation of this compound is according to [Minagawa07].

Chemical Formula: C7H9O8P

Molecular Weight: 252.12 Daltons

Monoisotopic Molecular Weight: 254.01915383989999 Daltons

SMILES: C(OP(=O)([O-])[O-])C1(C(O)C(O)C(O)C(=O)C=1)

InChI: InChI=1S/C7H11O8P/c8-4-1-3(2-15-16(12,13)14)5(9)7(11)6(4)10/h1,5-7,9-11H,2H2,(H2,12,13,14)/p-2/t5-,6+,7+/m1/s1

InChIKey: InChIKey=OIBXQBFLSXHTEZ-VQVTYTSYSA-L

Unification Links: PubChem:25203322

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -294.35812 Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

validamycin A biosynthesis :
valienone 7-phosphate + a reduced electron acceptor → validone 7-phosphate + an oxidized electron acceptor
valienone 7-phosphate + validone 7-phosphate → validoxylamine A

Reactions known to produce the compound:

validamycin A biosynthesis :
valienone + ATP → valienone 7-phosphate + ADP + H+


References

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

Minagawa07: Minagawa K, Zhang Y, Ito T, Bai L, Deng Z, Mahmud T (2007). "ValC, a new type of C7-Cyclitol kinase involved in the biosynthesis of the antifungal agent validamycin A." Chembiochem 8(6);632-41. PMID: 17335096


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 Jan 30, 2015, BIOCYC14B.