Deacetylsalannin
TL;DR: Deacetylsalannin (CAS 1110-56-1) is a chemical compound with molecular formula C32H42O8 and molecular weight 554.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-12-yl] 2-methylbut-2-enoate
Also Known As: Deacetylsalannin, 3-Deacetylsalannin, Phosphoribosyladenosine triphosphate, B0005-218851
| Molecular Formula | C32H42O8 |
|---|---|
| Molecular Weight | 554.29 g/mol |
| LogP | 4.7202 |
| Topological Polar Surface Area | 104.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 554.28796 |
| Heavy Atoms | 40 |
| Complexity | 1263.5077 |
Chemical Identifiers
| CAS Number | 1110-56-1 |
|---|---|
| SMILES | CC=C(C)C(=O)OC1CC(C2(COC3C2C1(C(C4(C3OC5C4=C(C(C5)C6=COC=C6)C)C)CC(=O)OC)C)C)O |
Product Overview
Deacetylsalannin (CAS 1110-56-1), with molecular formula C32H42O8 and molecular weight 554.29 g/mol. IUPAC: [6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.02,9.04,8.015,18]octadec-7-en-12-yl] 2-methylbut-2-enoate.
Chemical Property Profile of Deacetylsalannin
Property Insights of Deacetylsalannin
The XLogP value of 4.7202 indicates that Deacetylsalannin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Deacetylsalannin. Following Lipinski's Rule of Five, Deacetylsalannin has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Deacetylsalannin?
The CAS number of Deacetylsalannin is 1110-56-1.
What is the molecular formula of Deacetylsalannin?
The molecular formula of Deacetylsalannin is C32H42O8.
What is the molecular weight of Deacetylsalannin?
The molecular weight of Deacetylsalannin is 554.29 g/mol.
Where can I buy Deacetylsalannin?
You can request a quote for Deacetylsalannin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Deacetylsalannin?
Yes, KEHONG BIO provides custom synthesis services for Deacetylsalannin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.