9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate
TL;DR: 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate (CAS 7238-74-6) is a chemical compound with molecular formula C34H48O11 and molecular weight 632.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-acetyloxy-2-butanoyloxy-4,8,13-trimethyl-7-(2-methylbut-2-enoyloxy)-12-oxo-11,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradec-8-en-6-yl] octanoate
Also Known As: 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate
| Molecular Formula | C34H48O11 |
|---|---|
| Molecular Weight | 632.32 g/mol |
| LogP | 4.9735 |
| Topological Polar Surface Area | 144.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 632.31964 |
| Heavy Atoms | 45 |
| Complexity | 1282.489 |
Chemical Identifiers
| CAS Number | 7238-74-6 |
|---|---|
| SMILES | CCCCCCCC(=O)OC1C2C(=C(C1OC(=O)C(=CC)C)C)C3C4(C(CC2(C)OC(=O)C)OC(=O)CCC)C(O4)(C(=O)O3)C |
Product Overview
9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate (CAS 7238-74-6), with molecular formula C34H48O11 and molecular weight 632.32 g/mol. IUPAC: [4-acetyloxy-2-butanoyloxy-4,8,13-trimethyl-7-(2-methylbut-2-enoyloxy)-12-oxo-11,14-dioxatetracyclo[8.4.0.01,13.05,9]tetradec-8-en-6-yl] octanoate.
Chemical Property Profile of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate
Property Insights of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate
The XLogP value of 4.9735 indicates that 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.03 Ų indicates high polarity, suggesting 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate?
The CAS number of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate is 7238-74-6.
What is the molecular formula of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate?
The molecular formula of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate is C34H48O11.
What is the molecular weight of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate?
The molecular weight of 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate is 632.32 g/mol.
Where can I buy 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate?
You can request a quote for 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate?
Yes, KEHONG BIO provides custom synthesis services for 9-(Acetyloxy)-7-(butanoyloxy)-3,5a,9-trimethyl-2-[(2-methylbut-2-enoyl)oxy]-5-oxo-2,3b,5,5a,7,8,9,9a-octahydro-1H-azuleno[4,5-b]oxireno[c]furan-1-yl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.