ChemicalBook--->CAS DataBase List--->116296-31-2

116296-31-2

116296-31-2 Structure

116296-31-2 Structure
IdentificationBack Directory
[Name]

(UNDECYLTHIO)-ACETIC ACID
[CAS]

116296-31-2
[Synonyms]

3-TDA
3-THIATETRADECANOIC ACID
(UNDECYLTHIO)-ACETIC ACID
CZSSKBQAJULWPY-UHFFFAOYSA-N
Acetic acid, 2-(undecylthio)-
[Molecular Formula]

C13H26O2S
[MDL Number]

MFCD01098548
[MOL File]

116296-31-2.mol
[Molecular Weight]

246.41
Chemical PropertiesBack Directory
[Melting point ]

61-62 °C
[Boiling point ]

359.0±25.0 °C(Predicted)
[density ]

0.978±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

≤30mg/ml in ethanol;30mg/ml in DMSO;30mg/ml in dimethyl formamide
[form ]

crystalline solid
[pka]

3.85±0.10(Predicted)
Hazard InformationBack Directory
[Biological Activity]

3-thiatetradecanoic acid is an activator of ppar.the peroxisome proliferator-activated receptors (ppars) are transcription factors involved in fatty acid metabolism and energy homeostasis. the ppars also play crucial roles in the control of cellular growth and differentiation.
[in vitro]

in bt4cn cells, 3-thiatetradecanoic acid could activate all ppar subtypes dose-dependently. in cell culture experiments, the pparγ-selective ligand brl49653 moderately inhibited growth of bt4cn cells, while administration of 3-thiatetradecanoic acid led to a marked growth inhibition. moreover, the administration of the pparγ-selective antagonist gw9662 abolished brl49653-induced growth inhibition, but only marginally reduced the effect of 3-thiatetradecanoic acid [1].
[in vivo]

administration of 3-thiatetradecanoic acid increased mitochondrial and peroxisomal beta-oxidative capacity and carnitine palmitoyltransferase activity, but reduced free fatty acid and triacylglycerol levels in plasma compared to palmitic acid-treated rats and controls. 3-thiatetradecanoic acid administration was able to affect the fatty acid composition in plasma and liver by increasing the amount of monoenes [2].
[storage]

Store at -20°C
[References]

1. berge k, tronstad kj, flindt en, rasmussen th, madsen l, kristiansen k, berge rk. tetradecylthioacetic acid inhibits growth of rat glioma cells ex vivo and in vivo via ppar-dependent and ppar-independent pathways. carcinogenesis. 2001 nov;22(11):1747-55.2. asiedu, d.k.,froyland, l.,vaagenes, h., et al. long-term effect of tetradecylthioacetic acid: a study on plasma lipid profile and fatty acid composition and oxidation in different rat organs. biochimica et biophysica acta 1300, 86-96 (1996).3. pettersen rj, salem m, skorve j, ulvik rj, berge rk, nordrehaug je. pharmacology and safety of tetradecylthioacetic acid (tta): phase-1 study. j cardiovasc pharmacol. 2008 apr;51(4):410-7.
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