Deacetyleupaserrin
TL;DR: Deacetyleupaserrin (CAS 38456-39-2) is a chemical compound with molecular formula C20H26O6 and molecular weight 362.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3aR,4R,9R,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-(hydroxymethyl)but-2-enoate
Also Known As: Deacetyleupaserrin
| Molecular Formula | C20H26O6 |
|---|---|
| Molecular Weight | 362.17 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.17294 |
| Heavy Atoms | 26 |
| Complexity | 684.0 |
Chemical Identifiers
| CAS Number | 38456-39-2 |
|---|---|
| SMILES | CC=C(CO)C(=O)O[C@@H]1CC(=CC[C@H](C(=C[C@@H]2[C@@H]1C(=C)C(=O)O2)C)O)C |
| InChIKey | WQBVXCQSQYBGGT-BRSBDYLESA-N |
Product Overview
Deacetyleupaserrin (CAS 38456-39-2), with molecular formula C20H26O6 and molecular weight 362.17 g/mol. IUPAC: [(3aR,4R,9R,11aR)-9-hydroxy-6,10-dimethyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 2-(hydroxymethyl)but-2-enoate.
Chemical Property Profile of Deacetyleupaserrin
Property Insights of Deacetyleupaserrin
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Deacetyleupaserrin. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Deacetyleupaserrin. Following Lipinski's Rule of Five, Deacetyleupaserrin has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deacetyleupaserrin?
The CAS number of Deacetyleupaserrin is 38456-39-2.
What is the molecular formula of Deacetyleupaserrin?
The molecular formula of Deacetyleupaserrin is C20H26O6.
What is the molecular weight of Deacetyleupaserrin?
The molecular weight of Deacetyleupaserrin is 362.17 g/mol.
Where can I buy Deacetyleupaserrin?
You can request a quote for Deacetyleupaserrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deacetyleupaserrin?
Yes, KEHONG BIO provides custom synthesis services for Deacetyleupaserrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.