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
Metabolic Modeling Tutorial
discounted EARLY registration ends Dec 31, 2014
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MetaCyc Compound: (5S)-albaflavenol

Citations: [Lin06a, Zhao08]

Chemical Formula: C15H24O

Molecular Weight: 220.35 Daltons

Monoisotopic Molecular Weight: 220.1827153925 Daltons

SMILES: CC1(C23(C(C(O)C1)=C(C)C(C)(C)C(C2)CC3))

InChI: InChI=1S/C15H24O/c1-9-7-12(16)13-10(2)14(3,4)11-5-6-15(9,13)8-11/h9,11-12,16H,5-8H2,1-4H3/t9-,11-,12-,15+/m0/s1

InChIKey: InChIKey=ZRRTYQUKAJCICD-AVNXNWIJSA-N

Unification Links: ChEBI:51480 , KEGG:C17953 , PubChem:25137910

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): 232.9169 Inferred by computational analysis [Latendresse13]

Reactions known to consume the compound:

albaflavenone biosynthesis :
(5S)-albaflavenol + NADPH + oxygen + H+ → albaflavenone + NADP+ + 2 H2O

Reactions known to produce the compound:

albaflavenone biosynthesis :
(+)-epi-isozizaene + NADPH + oxygen + H+(5S)-albaflavenol + NADP+ + H2O


References

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

Lin06a: Lin X, Hopson R, Cane DE (2006). "Genome mining in Streptomyces coelicolor: molecular cloning and characterization of a new sesquiterpene synthase." J Am Chem Soc 128(18);6022-3. PMID: 16669656

Zhao08: Zhao B, Lin X, Lei L, Lamb DC, Kelly SL, Waterman MR, Cane DE (2008). "Biosynthesis of the Sesquiterpene Antibiotic Albaflavenone in Streptomyces coelicolor A3(2)." J Biol Chem 283(13);8183-9. PMID: 18234666


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.