Ustilipid A
TL;DR: Ustilipid A (CAS 233593-20-9) is a chemical compound with molecular formula C36H64O13 and molecular weight 704.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,5S,6R)-3-acetyloxy-2-(acetyloxymethyl)-5-hexanoyloxy-6-[(2R,3S)-2,3,4-trihydroxybutoxy]oxan-4-yl] hexadecanoate
Also Known As: Ustilipid A, J2.195.271K, [(2R,3R,4S,5S,6R)-3-acetyloxy-2-(acetyloxymethyl)-5-hexanoyloxy-6-[(2R,3S)-2,3,4-trihydroxybutoxy]oxan-4-yl] hexadecanoate, [(2R,3S)-2,3,4-Trihydroxybutyl]2-O-hexanoyl-3-O-hexadecanoyl-4-O,6-O-diacetyl-beta-D-mannopyranoside, ((2R,3R,4S,5S,6R)-3-acetyloxy-2-(acetyloxymethyl)-5-hexanoyloxy-6-((2R,3S)-2,3,4-trihydroxybutoxy)oxan-4-yl) hexadecanoate
| Molecular Formula | C36H64O13 |
|---|---|
| Molecular Weight | 704.43 g/mol |
| LogP | 4.822 |
| Topological Polar Surface Area | 184.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 28 |
| Exact Mass | 704.4347 |
| Heavy Atoms | 49 |
| Complexity | 913.36694 |
Chemical Identifiers
| CAS Number | 233593-20-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@H]1[C@@H]([C@H](O[C@H]([C@H]1OC(=O)CCCCC)OC[C@H]([C@H](CO)O)O)COC(=O)C)OC(=O)C |
Product Overview
Ustilipid A (CAS 233593-20-9), with molecular formula C36H64O13 and molecular weight 704.43 g/mol. IUPAC: [(2R,3R,4S,5S,6R)-3-acetyloxy-2-(acetyloxymethyl)-5-hexanoyloxy-6-[(2R,3S)-2,3,4-trihydroxybutoxy]oxan-4-yl] hexadecanoate.
Chemical Property Profile of Ustilipid A
Property Insights of Ustilipid A
The XLogP value of 4.822 indicates that Ustilipid A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 184.35 Ų indicates high polarity, suggesting Ustilipid A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ustilipid A has 3 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 Ustilipid A?
The CAS number of Ustilipid A is 233593-20-9.
What is the molecular formula of Ustilipid A?
The molecular formula of Ustilipid A is C36H64O13.
What is the molecular weight of Ustilipid A?
The molecular weight of Ustilipid A is 704.43 g/mol.
Where can I buy Ustilipid A?
You can request a quote for Ustilipid A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ustilipid A?
Yes, KEHONG BIO provides custom synthesis services for Ustilipid A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.