Desacetyluvaricin
TL;DR: Desacetyluvaricin (CAS 98767-45-4) is a chemical compound with molecular formula C37H66O6 and molecular weight 606.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4-[(13R)-13-hydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
Also Known As: Desacetyluvaricin, Squamocin L, BULLANIN, (+)-Desacetyluvaricin, (2S)-4-[(13R)-13-hydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one
| Molecular Formula | C37H66O6 |
|---|---|
| Molecular Weight | 606.49 g/mol |
| LogP | 11.2 |
| Topological Polar Surface Area | 85.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 25 |
| Exact Mass | 606.48596 |
| Heavy Atoms | 43 |
| Complexity | 768.0 |
Chemical Identifiers
| CAS Number | 98767-45-4 |
|---|---|
| SMILES | CCCCCCCCCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2CC[C@@H](O2)[C@@H](CCCCCCCCCCCCC3=C[C@@H](OC3=O)C)O)O |
| InChIKey | URLVCROWVOSNPT-HJPPHTJLSA-N |
Product Overview
Desacetyluvaricin (CAS 98767-45-4), with molecular formula C37H66O6 and molecular weight 606.49 g/mol. IUPAC: (2S)-4-[(13R)-13-hydroxy-13-[(2R,5R)-5-[(2R,5R)-5-[(1S)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]-2-methyl-2H-furan-5-one.
Chemical Property Profile of Desacetyluvaricin
Property Insights of Desacetyluvaricin
The XLogP value of 11.2 indicates that Desacetyluvaricin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Desacetyluvaricin. Following Lipinski's Rule of Five, Desacetyluvaricin has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desacetyluvaricin?
The CAS number of Desacetyluvaricin is 98767-45-4.
What is the molecular formula of Desacetyluvaricin?
The molecular formula of Desacetyluvaricin is C37H66O6.
What is the molecular weight of Desacetyluvaricin?
The molecular weight of Desacetyluvaricin is 606.49 g/mol.
Where can I buy Desacetyluvaricin?
You can request a quote for Desacetyluvaricin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desacetyluvaricin?
Yes, KEHONG BIO provides custom synthesis services for Desacetyluvaricin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.