alpha-CDS
TL;DR: alpha-CDS (CAS 120366-24-7) is a chemical compound with molecular formula C36H60O84S18 and molecular weight 2411.54 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[31,32,33,34,35,36,37,38,39,40,41,42-dodecasulfooxy-10,15,20,25,30-pentakis(sulfooxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontan-5-yl]methyl hydrogen sulfate
Also Known As: alpha-CDS, A-CDS, Cyclohexaamylose polysulfate, .alpha.-CDS, alpha-Cyclodextrin sulfate
| Molecular Formula | C36H60O84S18 |
|---|---|
| Molecular Weight | 2411.54 g/mol |
| LogP | -19.8 |
| Topological Polar Surface Area | 1410.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 84 |
| Rotatable Bonds | 42 |
| Exact Mass | 2411.5396 |
| Heavy Atoms | 138 |
| Complexity | 5430.0 |
Chemical Identifiers
| CAS Number | 120366-24-7 |
|---|---|
| SMILES | C(C1C2C(C(C(O1)OC3C(OC(C(C3OS(=O)(=O)O)OS(=O)(=O)O)OC4C(OC(C(C4OS(=O)(=O)O)OS(=O)(=O)O)OC5C(OC(C(C5OS(=O)(=O)O)OS(=O)(=O)O)OC6C(OC(C(C6OS(=O)(=O)O)OS(=O)(=O)O)OC7C(OC(O2)C(C7OS(=O)(=O)O)OS(=O)(=O)O)COS(=O)(=O)O)COS(=O)(=O)O)COS(=O)(=O)O)COS(=O)(=O)O)COS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O)OS(=O)(=O)O |
| InChIKey | SPIUHJINJWTDQE-UHFFFAOYSA-N |
Product Overview
alpha-CDS (CAS 120366-24-7), with molecular formula C36H60O84S18 and molecular weight 2411.54 g/mol. IUPAC: [31,32,33,34,35,36,37,38,39,40,41,42-dodecasulfooxy-10,15,20,25,30-pentakis(sulfooxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontan-5-yl]methyl hydrogen sulfate.
Chemical Property Profile of alpha-CDS
Property Insights of alpha-CDS
The XLogP value of -19.8 indicates that alpha-CDS is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 1410.0 Ų indicates high polarity, suggesting alpha-CDS may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-CDS has 18 hydrogen bond donor(s) and 84 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-CDS?
The CAS number of alpha-CDS is 120366-24-7.
What is the molecular formula of alpha-CDS?
The molecular formula of alpha-CDS is C36H60O84S18.
What is the molecular weight of alpha-CDS?
The molecular weight of alpha-CDS is 2411.54 g/mol.
Where can I buy alpha-CDS?
You can request a quote for alpha-CDS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-CDS?
Yes, KEHONG BIO provides custom synthesis services for alpha-CDS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.