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
twitter

Escherichia coli K-12 substr. MG1655 Compound: S-adenosyl-1,8-diamino-3-thiooctane

Chemical Formula: C18H33N7O3S

Molecular Weight: 427.56 Daltons

Monoisotopic Molecular Weight: 425.2209085878 Daltons

SMILES: C([N+])CCCCC(CC[N+])SCC1(OC(C(C1O)O)N2(C=NC3(=C2N=CN=C3N)))

InChI: InChI=1S/C18H31N7O3S/c19-6-3-1-2-4-11(5-7-20)29-8-12-14(26)15(27)18(28-12)25-10-24-13-16(21)22-9-23-17(13)25/h9-12,14-15,18,26-27H,1-8,19-20H2,(H2,21,22,23)/p+2/t11?,12-,14-,15-,18-/m1/s1

InChIKey: InChIKey=YETXSQDQSWLLJR-JJPFLPBXSA-P

Unification Links: PubChem:25202569

Standard Gibbs Free Energy of Change Formation (ΔfG in kcal/mol): -36.419

Enzymes inhibited by S-adenosyl-1,8-diamino-3-thiooctane, sorted by the type of inhibition, are:

Inhibitor (Mechanism unknown) of: spermidine synthase [Tabor85, Pegg83, Pegg86]


References

Pegg83: Pegg AE, Bitonti AJ, McCann PP, Coward JK (1983). "Inhibition of bacterial aminopropyltransferases by S-adenosyl-1,8-diamino-3-thiooctane and by dicyclohexylamine." FEBS Lett 155(2);192-6. PMID: 6406265

Pegg86: Pegg AE, Coward JK, Talekar RR, Secrist JA (1986). "Effects of certain 5'-substituted adenosines on polyamine synthesis: selective inhibitors of spermine synthase." Biochemistry 1986;25(14);4091-7. PMID: 3091070

Tabor85: Tabor CW, Tabor H (1985). "Polyamines in microorganisms." Microbiol Rev 1985;49(1);81-99. PMID: 3157043


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 18.5 on Sat Nov 22, 2014, BIOCYC14A.