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Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
12/28 - 12/31
for maintenance.
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
12/28 - 12/31
for maintenance.
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
12/28 - 12/31
for maintenance.
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
BioCyc websites down
12/28 - 12/31
for maintenance.
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MetaCyc Compound: UDP-3-dehydro-α-D-glucose

Synonyms: UDP-3-ketoglucose, UDP-3-keto-α-D-glucose

Chemical Formula: C15H20N2O17P2

Molecular Weight: 562.27 Daltons

Monoisotopic Molecular Weight: 564.0393703123 Daltons

SMILES: C(O)C1(C(O)C(=O)C(O)C(O1)OP(=O)([O-])OP(=O)([O-])OCC2(C(O)C(O)C(O2)N3(C=CC(=O)NC(=O)3)))

InChI: InChI=1S/C15H22N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-9,11-14,18,20-21,23-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/p-2/t5-,6-,8-,9-,11-,12-,13-,14?/m1/s1

InChIKey: InChIKey=VRDZHCNPFRUVRQ-GLJOCCMVSA-L

Unification Links: ChEBI:32274 , KEGG:C12210 , PubChem:25245179

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -580.82587 Inferred by computational analysis [Latendresse13]

Reactions known to produce the compound:

kanosamine biosynthesis I :
UDP-α-D-glucose + NAD+UDP-3-dehydro-α-D-glucose + NADH + H+

Reactions known to both consume and produce the compound:

kanosamine biosynthesis I :
UDP-3-dehydro-α-D-glucose + L-glutamine ↔ UDP-α-D-kanosamine + 2-oxoglutaramate


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 Sat Dec 20, 2014, BIOCYC14B.