Metabolic Modeling Tutorial
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BioCyc websites down
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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: (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 Sun Dec 21, 2014, BIOCYC14B.