D-Cellopentose Heptadecaacetate
TL;DR: D-Cellopentose Heptadecaacetate (CAS 83058-38-2) is a chemical compound with molecular formula C64H86O43 and molecular weight 1542.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5-diacetyloxy-3-[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[4,5,6-triacetyloxy-2-(acetyloxymethyl)oxan-3-yl]oxyoxan-3-yl]oxyoxan-2-yl]methyl acetate
Also Known As: D-Cellopentose Heptadecaacetate, [4,5-diacetyloxy-3-[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[4,5,6-triacetyloxy-2-(acetyloxymethyl)oxan-3-yl]oxyoxan-3-yl]oxyoxan-2-yl]methyl acetate
| Molecular Formula | C64H86O43 |
|---|---|
| Molecular Weight | 1542.45 g/mol |
| LogP | -2.221 |
| Topological Polar Surface Area | 530.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 43 |
| Rotatable Bonds | 30 |
| Exact Mass | 1542.4542 |
| Heavy Atoms | 107 |
| Complexity | 3239.3906 |
Chemical Identifiers
| CAS Number | 83058-38-2 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC2C(OC(C(C2OC(=O)C)OC(=O)C)OC3C(OC(C(C3OC(=O)C)OC(=O)C)OC(=O)C)COC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)OC4C(C(C(C(O4)COC(=O)C)OC5C(C(C(C(O5)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
D-Cellopentose Heptadecaacetate (CAS 83058-38-2), with molecular formula C64H86O43 and molecular weight 1542.45 g/mol. IUPAC: [4,5-diacetyloxy-3-[3,4-diacetyloxy-6-(acetyloxymethyl)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-6-[4,5-diacetyloxy-2-(acetyloxymethyl)-6-[4,5,6-triacetyloxy-2-(acetyloxymethyl)oxan-3-yl]oxyoxan-3-yl]oxyoxan-2-yl]methyl acetate.
Chemical Property Profile of D-Cellopentose Heptadecaacetate
Property Insights of D-Cellopentose Heptadecaacetate
The XLogP value of -2.221 indicates that D-Cellopentose Heptadecaacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 530.17 Ų indicates high polarity, suggesting D-Cellopentose Heptadecaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, D-Cellopentose Heptadecaacetate has 0 hydrogen bond donor(s) and 43 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-Cellopentose Heptadecaacetate?
The CAS number of D-Cellopentose Heptadecaacetate is 83058-38-2.
What is the molecular formula of D-Cellopentose Heptadecaacetate?
The molecular formula of D-Cellopentose Heptadecaacetate is C64H86O43.
What is the molecular weight of D-Cellopentose Heptadecaacetate?
The molecular weight of D-Cellopentose Heptadecaacetate is 1542.45 g/mol.
Where can I buy D-Cellopentose Heptadecaacetate?
You can request a quote for D-Cellopentose Heptadecaacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-Cellopentose Heptadecaacetate?
Yes, KEHONG BIO provides custom synthesis services for D-Cellopentose Heptadecaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.