Products 67526-95-8
CAS 67526-95-8 appears in our catalog under these names: Thapsigargin, 95% , Thapsigargin, >95% (HPLC), Thapsigargin, Thapsigargin/ 99.3% (existing batch purity), Thapsigargin, 97%. Offered by: Thermo Scientific (Alfa Aesar), TRC, GLPBio, TargetMol, Biosynth. Available pack sizes: 5mg, 1mg, 10mg, 2,5mg, 0,5mg, 2mg, 25mg, 50mg.
Thapsigargin is an organic heterotricyclic compound that is a hexa-oxygenated 6,7-guaianolide isolated fron the roots of Thapsia garganica L., Apiaceae. A potent skin irritant, it is used in traditional medicine as a counter-irritant. Thapsigargin inhibits Ca2+-transporting ATPase mediated uptake of calcium ions into sarcoplasmic reticulum and is used in experimentation examining the impacts of increasing cytosolic calcium concentrations. It has a role as a calcium channel blocker and an EC 3.6.3.8 (Ca(2+)-transporting ATPase) inhibitor. It is an organic heterotricyclic compound, a sesquiterpene lactone and a butyrate ester.
Source: ChEBI
| Molecular formula | C34H50O12 |
|---|---|
| Molecular weight | 650.8 g/mol |
| IUPAC name | [(3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate |
| InChIKey | IXFPJGBNCFXKPI-FSIHEZPISA-N |
| SMILES | CCCCCCCC(=O)O[C@H]1[C@H]2C(=C([C@@H]1OC(=O)/C(=C\C)/C)C)[C@H]3[C@]([C@H](C[C@]2(C)OC(=O)C)OC(=O)CCC)([C@](C(=O)O3)(C)O)O |
Computed by PubChem (NCBI)