Cucurbitacin E
TL;DR: Cucurbitacin E (CAS 18444-66-1) is a chemical compound with molecular formula C32H44O8 and molecular weight 556.3036 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate
Also Known As: Cucurbitacin E, [(E,6R)-6-[(8S,9R,10R,13R,14S,16R,17R)-2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthren-17-yl]-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate, [6-(2,16-dihydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-8,10,12,15,16,17-hexahydro-7H-cyclopenta[a]phenanthren-17-yl)-6-hydroxy-2-methyl-5-oxohept-3-en-2-yl] acetate
Technical Specifications
| Molecular Formula | C32H44O8 |
| Molecular Weight | 556.3036 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 556.3036 Da |
| Heavy Atoms | 40 |
| Complexity | 1270.0 |
| SMILES | CC(=O)OC(C)(C)C=CC(=O)C(C)(C1C(CC2(C1(CC(=O)C3(C2CC=C4C3C=C(C(=O)C4(C)C)O)C)C)C)O)O |
| InChIKey | NDYMQXYDSVBNLL-UHFFFAOYSA-N |
Chemical Property Profile of Cucurbitacin E
Property Insights of Cucurbitacin E
The XLogP value of 3.2 indicates that Cucurbitacin E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cucurbitacin E. Following Lipinski's Rule of Five, Cucurbitacin E has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cucurbitacin E?
The CAS number of Cucurbitacin E is 18444-66-1.
What is the molecular formula of Cucurbitacin E?
The molecular formula of Cucurbitacin E is C32H44O8.
What is the molecular weight of Cucurbitacin E?
The molecular weight of Cucurbitacin E is 556.3036 g/mol.
Where can I buy Cucurbitacin E?
You can request a quote for Cucurbitacin E directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cucurbitacin E?
Yes, CoreyChem provides custom synthesis services for Cucurbitacin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.