TL;DR: Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) (CAS 15507-52-5) is a chemical compound with molecular formula C29H48O3 and molecular weight 444.36035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] methyl carbonate
Also Known As: Cholesteryl methyl carbonate, Cholesteryl methylcarbonate, Cholesterol, methylcarbonate, Cholesterol Methyl Carbonate, Cholesterol, methyl carbonate
| Molecular Formula | C29H48O3 |
| Molecular Weight | 444.36035 g/mol |
| XLogP | 9.5 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.36035 Da |
| Heavy Atoms | 32 |
| Complexity | 711.0 |
| SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)OC)C)C |
| InChIKey | WHMGDIMLSAAHJQ-UHFFFAOYSA-N |
The XLogP value of 9.5 indicates that Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) is 15507-52-5.
The molecular formula of Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) is C29H48O3.
The molecular weight of Cholest-5-en-3-ol (3beta)-, 3-(methyl carbonate) is 444.36035 g/mol.
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