TL;DR: Monactin (CAS 92759-00-7) is a chemical compound with molecular formula C41H66O12 and molecular weight 750.45544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-ethyl-2,11,14,20,23,29,32-heptamethyl-4,13,22,31,37,38,39,40-octaoxapentacyclo[32.2.1.17,10.116,19.125,28]tetracontane-3,12,21,30-tetrone
Also Known As: Monactin, Akd-1B, Antibiotic AKD 1B, Nonactin, 5-demethyl-5-ethyl-, 5-ethyl-2,11,14,20,23,29,32-heptamethyl-4,13,22,31,37,38,39,40-octaoxapentacyclo[32.2.1.17,10.116,19.125,28]tetracontane-3,12,21,30-tetrone
| Molecular Formula | C41H66O12 |
| Molecular Weight | 750.45544 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 142.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 1 |
| Exact Mass | 750.45544 Da |
| Heavy Atoms | 53 |
| Complexity | 1240.0 |
| SMILES | CCC1CC2CCC(O2)C(C(=O)OC(CC3CCC(O3)C(C(=O)OC(CC4CCC(O4)C(C(=O)OC(CC5CCC(O5)C(C(=O)O1)C)C)C)C)C)C)C |
| InChIKey | YPUPRVWRYDPGCW-UHFFFAOYSA-N |
The XLogP value of 7.2 indicates that Monactin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 142.0 Ų indicates high polarity, suggesting Monactin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Monactin has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Monactin is 92759-00-7.
The molecular formula of Monactin is C41H66O12.
The molecular weight of Monactin is 750.45544 g/mol.
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