Asiminacin
TL;DR: Asiminacin (CAS 129214-51-3) is a chemical compound with molecular formula C37H66O7 and molecular weight 622.48083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-4-[(13R)-13-[(5R)-5-[(2R,5R)-5-[(1S,5S)-1,5-dihydroxyundecyl]oxolan-2-yl]oxolan-2-yl]-13-hydroxytridecyl]-2-methyl-2H-furan-5-one
Also Known As: Asiminacin, 3-{13-[5'-(1,5-Dihydroxyundecyl)[2,2'-bioxolan]-5-yl]-13-hydroxytridecyl}-5-methylfuran-2(5H)-one, (2S)-4-[(13R)-13-[(5R)-5-[(2R,5R)-5-[(1S,5S)-1,5-dihydroxyundecyl]oxolan-2-yl]oxolan-2-yl]-13-hydroxytridecyl]-2-methyl-2H-furan-5-one, (5S)-3-[(13R)-13-{(2R,2'R,5'R)-5'-[(1S,5S)-1,5-Dihydroxyundecyl][2,2'-bioxolan]-5-yl}-13-hydroxytridecyl]-5-methylfuran-2(5H)-one
Technical Specifications
| Molecular Formula | C37H66O7 |
| Molecular Weight | 622.48083 g/mol |
| XLogP | 9.5 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 25 |
| Exact Mass | 622.48083 Da |
| Heavy Atoms | 44 |
| Complexity | 801.0 |
| SMILES | CCCCCC[C@@H](CCC[C@@H]([C@H]1CC[C@@H](O1)[C@H]2CCC(O2)[C@@H](CCCCCCCCCCCCC3=C[C@@H](OC3=O)C)O)O)O |
| InChIKey | DAEFUOXKPZLQMM-RMAYOPNDSA-N |
Chemical Property Profile of Asiminacin
Property Insights of Asiminacin
The XLogP value of 9.5 indicates that Asiminacin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Asiminacin. Following Lipinski's Rule of Five, Asiminacin has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Asiminacin?
The CAS number of Asiminacin is 129214-51-3.
What is the molecular formula of Asiminacin?
The molecular formula of Asiminacin is C37H66O7.
What is the molecular weight of Asiminacin?
The molecular weight of Asiminacin is 622.48083 g/mol.
Where can I buy Asiminacin?
You can request a quote for Asiminacin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Asiminacin?
Yes, CoreyChem provides custom synthesis services for Asiminacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.