Desglucodesrhamnoparillin
TL;DR: Desglucodesrhamnoparillin (CAS 96351-58-5) is a chemical compound with molecular formula C39H64O13 and molecular weight 740.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-2-yl]methoxy]oxane-3,4,5-triol
Also Known As: Desglucodesrhamnoparillin, Deglucoderhamnoparillin, 2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-2-yl]methoxy]oxane-3,4,5-triol
| Molecular Formula | C39H64O13 |
|---|---|
| Molecular Weight | 740.43 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 740.4347 |
| Heavy Atoms | 52 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 96351-58-5 |
|---|---|
| SMILES | CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C)C)C)OC1 |
| InChIKey | XERVTTUAMKCJIM-UHFFFAOYSA-N |
Product Overview
Desglucodesrhamnoparillin (CAS 96351-58-5), with molecular formula C39H64O13 and molecular weight 740.43 g/mol. IUPAC: 2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-16-yl)oxyoxan-2-yl]methoxy]oxane-3,4,5-triol.
Chemical Property Profile of Desglucodesrhamnoparillin
Property Insights of Desglucodesrhamnoparillin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Desglucodesrhamnoparillin. The TPSA of 197.0 Ų indicates high polarity, suggesting Desglucodesrhamnoparillin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Desglucodesrhamnoparillin has 7 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 Desglucodesrhamnoparillin?
The CAS number of Desglucodesrhamnoparillin is 96351-58-5.
What is the molecular formula of Desglucodesrhamnoparillin?
The molecular formula of Desglucodesrhamnoparillin is C39H64O13.
What is the molecular weight of Desglucodesrhamnoparillin?
The molecular weight of Desglucodesrhamnoparillin is 740.43 g/mol.
Where can I buy Desglucodesrhamnoparillin?
You can request a quote for Desglucodesrhamnoparillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desglucodesrhamnoparillin?
Yes, KEHONG BIO provides custom synthesis services for Desglucodesrhamnoparillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.