KST-1A4689
TL;DR: KST-1A4689 (CAS 40910-99-4) is a chemical compound with molecular formula C140H262O19 and molecular weight 2247.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[6-[3,4-di(hexadecanoyloxy)-2,5-bis(hexadecanoyloxymethyl)oxolan-2-yl]oxy-3,4,5-tri(hexadecanoyloxy)oxan-2-yl]methyl hexadecanoate
Also Known As: KST-1A4689, EINECS 254-251-8, [(2s,3s,4r,5r)-4-hexadecanoyloxy-2,5-bis(hexadecanoyloxymethyl)-2-[(2r,3r,4s,5r,6r)-3,4,5-tri(hexadecanoyloxy)-6-(hexadecanoyloxymethyl)tetrahydropyran-2-yl]oxy-tetrahydrofuran-3-yl] hexadecanoate, ((2S,3S,4R,5R)-4-Hexadecanoyloxy-2,5-bis(hexadecanoyloxymethyl)-2-((2R,3R,4S,5R,6R)-3,4,5-tri(hexadecanoyloxy)-6-(hexadecanoyloxymethyl)oxan-2-yl)oxyoxolan-3-yl) hexadecanoate, [2-[3,4-dihexadecanoyloxy-2,5-bis(hexadecanoyloxymethyl)oxolan-2-yl]oxy-3,5-dihexadecanoyloxy-6-(hexadecanoyloxymethyl)oxan-4-yl] hexadecanoate
| Molecular Formula | C140H262O19 |
|---|---|
| Molecular Weight | 2247.95 g/mol |
| LogP | 57.7 |
| Topological Polar Surface Area | 238.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 133 |
| Exact Mass | 2247.9536 |
| Heavy Atoms | 159 |
| Complexity | 3180.0 |
Chemical Identifiers
| CAS Number | 40910-99-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(C(O1)OC2(C(C(C(O2)COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | WJPZXFWMBSJTPE-UHFFFAOYSA-N |
Product Overview
KST-1A4689 (CAS 40910-99-4), with molecular formula C140H262O19 and molecular weight 2247.95 g/mol. IUPAC: [6-[3,4-di(hexadecanoyloxy)-2,5-bis(hexadecanoyloxymethyl)oxolan-2-yl]oxy-3,4,5-tri(hexadecanoyloxy)oxan-2-yl]methyl hexadecanoate.
Chemical Property Profile of KST-1A4689
Property Insights of KST-1A4689
The XLogP value of 57.7 indicates that KST-1A4689 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 238.0 Ų indicates high polarity, suggesting KST-1A4689 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, KST-1A4689 has 0 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A4689?
The CAS number of KST-1A4689 is 40910-99-4.
What is the molecular formula of KST-1A4689?
The molecular formula of KST-1A4689 is C140H262O19.
What is the molecular weight of KST-1A4689?
The molecular weight of KST-1A4689 is 2247.95 g/mol.
Where can I buy KST-1A4689?
You can request a quote for KST-1A4689 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A4689?
Yes, KEHONG BIO provides custom synthesis services for KST-1A4689 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.