thapsigargin
TL;DR: thapsigargin (CAS 67526-95-8) is a chemical compound with molecular formula C34H50O12 and molecular weight 650.3302 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-(2-methylbut-2-enoyloxy)-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate
Also Known As: thapsigargin, THAPSIGARGINE, Azuleno[4,5-b]furan, octanoic acid deriv., [6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-(2-methylbut-2-enoyloxy)-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate, 6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-[(2-methylbut-2-enoyl)oxy]-2-oxo-2,3,3a,4,5,6,6a,7,8,9b-decahydroazuleno[4,5-b]furan-7-yl octanoate
Technical Specifications
| Molecular Formula | C34H50O12 |
| Molecular Weight | 650.3302 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 17 |
| Exact Mass | 650.3302 Da |
| Heavy Atoms | 46 |
| Complexity | 1270.0 |
| SMILES | CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C(C(CC2(C)OC(=O)C)OC(=O)CCC)(C(C(=O)O3)(C)O)O |
| InChIKey | IXFPJGBNCFXKPI-UHFFFAOYSA-N |
Product Description
Applications: thapsigargin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
thapsigargin (CAS 67526-95-8) is a fine chemical with the molecular formula C34H50O12 and a molecular weight of 650.33 g/mol. Synonyms include thapsigargin and THAPSIGARGINE.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of thapsigargin
Property Insights of thapsigargin
The XLogP value of 3.6 indicates that thapsigargin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting thapsigargin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, thapsigargin has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of thapsigargin?
The CAS number of thapsigargin is 67526-95-8.
What is the molecular formula of thapsigargin?
The molecular formula of thapsigargin is C34H50O12.
What is the molecular weight of thapsigargin?
The molecular weight of thapsigargin is 650.3302 g/mol.
What are the applications of thapsigargin?
thapsigargin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Where can I buy thapsigargin?
You can request a quote for thapsigargin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for thapsigargin?
Yes, CoreyChem provides custom synthesis services for thapsigargin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.