Glaucarubol pentaacetate
TL;DR: Glaucarubol pentaacetate (CAS 118697-12-4) is a chemical compound with molecular formula C30H38O13 and molecular weight 606.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,12,15-tetraacetyloxy-2,6,14-trimethyl-11,16-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-en-17-yl)methyl acetate
Also Known As: Glaucarubol pentaacetate, 11,16-dioxopicras-3-ene-1,2,12,15,20-pentayl pentaacetate
| Molecular Formula | C30H38O13 |
|---|---|
| Molecular Weight | 606.23 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 606.23126 |
| Heavy Atoms | 43 |
| Complexity | 1280.0 |
Chemical Identifiers
| CAS Number | 118697-12-4 |
|---|---|
| SMILES | CC1C2C(C(=O)OC3C2(C(C(=O)C1OC(=O)C)C4(C(C3)C(=CC(C4OC(=O)C)OC(=O)C)C)C)COC(=O)C)OC(=O)C |
| InChIKey | BQTRFRZIHPSCQK-UHFFFAOYSA-N |
Product Overview
Glaucarubol pentaacetate (CAS 118697-12-4), with molecular formula C30H38O13 and molecular weight 606.23 g/mol. IUPAC: (3,4,12,15-tetraacetyloxy-2,6,14-trimethyl-11,16-dioxo-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-en-17-yl)methyl acetate.
Chemical Property Profile of Glaucarubol pentaacetate
Property Insights of Glaucarubol pentaacetate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glaucarubol pentaacetate. The TPSA of 175.0 Ų indicates high polarity, suggesting Glaucarubol pentaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glaucarubol pentaacetate has 0 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glaucarubol pentaacetate?
The CAS number of Glaucarubol pentaacetate is 118697-12-4.
What is the molecular formula of Glaucarubol pentaacetate?
The molecular formula of Glaucarubol pentaacetate is C30H38O13.
What is the molecular weight of Glaucarubol pentaacetate?
The molecular weight of Glaucarubol pentaacetate is 606.23 g/mol.
Where can I buy Glaucarubol pentaacetate?
You can request a quote for Glaucarubol pentaacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glaucarubol pentaacetate?
Yes, KEHONG BIO provides custom synthesis services for Glaucarubol pentaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.