Pathway Tools
Intro Tutorial
discounted registration ends Sept 5, 2015
Pathway Tools
Intro Tutorial
discounted registration ends Sept 5, 2015
Pathway Tools
Intro Tutorial
discounted registration ends Sept 5, 2015
Pathway Tools
Intro Tutorial
discounted registration ends Sept 5, 2015
Pathway Tools
Intro Tutorial
discounted registration ends Sept 5, 2015
twitter

Escherichia coli K-12 substr. MG1655 Compound: pimeloyl-CoA

Synonyms: 6-carboxyhexanoyl-CoA, pimelyl-CoA

Citations: [Sanyal94]

Chemical Formula: C28H41N7O19P3S

Molecular Weight: 904.65 Daltons

Monoisotopic Molecular Weight: 909.1782025529 Daltons

pimeloyl-CoA compound structure

SMILES: CC(C)(C(O)C(=O)NCCC(=O)NCCSC(CCCCCC([O-])=O)=O)COP(=O)(OP(=O)(OCC1(C(OP([O-])(=O)[O-])C(O)C(O1)N3(C2(=C(C(N)=NC=N2)N=C3))))[O-])[O-]

InChI: InChI=1S/C28H46N7O19P3S/c1-28(2,23(41)26(42)31-9-8-17(36)30-10-11-58-19(39)7-5-3-4-6-18(37)38)13-51-57(48,49)54-56(46,47)50-12-16-22(53-55(43,44)45)21(40)27(52-16)35-15-34-20-24(29)32-14-33-25(20)35/h14-16,21-23,27,40-41H,3-13H2,1-2H3,(H,30,36)(H,31,42)(H,37,38)(H,46,47)(H,48,49)(H2,29,32,33)(H2,43,44,45)/p-5/t16-,21-,22-,23+,27-/m1/s1

InChIKey: InChIKey=LYCRXMTYUZDUGA-UYRKPTJQSA-I

Unification Links: ChEBI:57360 , IAF1260:36728 , KEGG:C01063 , PubChem:45266589

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -922.439

Reactions known to consume the compound:

Not in pathways:
L-alanine + pimeloyl-CoA + H+ → CO2 + 8-amino-7-oxononanoate + coenzyme A


References

Sanyal94: Sanyal I, Lee S, Flint D (1994). "Biosynthesis of pimeloyl-CoA, a biotin precursor in Escherichia coli, follows a modified fatty acid synthesis pathway: 13C labeling studies." Journal of the American Chemical Society.


Report Errors or Provide Feedback
Please cite the following article in publications resulting from the use of EcoCyc: Nucleic Acids Research 41:D605-12 2013
Page generated by SRI International Pathway Tools version 19.0 on Sun Aug 30, 2015, BIOCYC14B.