TL;DR: Okadaol (CAS 131959-12-1) is a chemical compound with molecular formula C44H70O12 and molecular weight 790.48676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[5-hydroxy-8-[(E)-4-[4-hydroxy-2-[1-hydroxy-3-(9-methyl-1-oxaspiro[5.5]undecan-10-yl)butyl]-3-methylidenespiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-10-methyl-1,4,7-trioxaspiro[5.5]undec-10-en-2-yl]-2-methylpropane-1,2-diol
Also Known As: Okadaol, 3-[7-hydroxy-4-[(E)-4-[4-hydroxy-2-[1-hydroxy-3-(9-methyl-5-oxaspiro[5.5]undecan-10-yl)butyl]-3-methylidenespiro[4a,7,8,8a-tetrahydro-4H-pyrano[3,2-b]pyran-6,5'-oxolane]-2'-yl]but-3-en-2-yl]-2-methyl-5,8,11-trioxaspiro[5.5]undec-1-en-10-yl]-2-methylpropane-1,2-diol
| Molecular Formula | C44H70O12 |
| Molecular Weight | 790.48676 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 166.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 790.48676 Da |
| Heavy Atoms | 56 |
| Complexity | 1440.0 |
| SMILES | CC1CCC2(CCCCO2)CC1C(C)CC(C3C(=C)C(C4C(O3)CCC5(O4)CCC(O5)/C=C/C(C)C6CC(=CC7(O6)C(OCC(O7)CC(C)(CO)O)O)C)O)O |
| InChIKey | UYJJHCRMSRYIAM-MDZDMXLPSA-N |
The XLogP value of 3.0 indicates that Okadaol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.0 Ų indicates high polarity, suggesting Okadaol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Okadaol has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Okadaol is 131959-12-1.
The molecular formula of Okadaol is C44H70O12.
The molecular weight of Okadaol is 790.48676 g/mol.
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