TL;DR: Cholesteryl hemisuccinate (CAS 1510-21-0) is a chemical compound with molecular formula C31H50O4 and molecular weight 486.3709 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-4-oxobutanoic acid
Also Known As: Cholesteryl hemisuccinate, Cholesteryl succinate, Cholesterol Hydrogen Succinate, Cholesterol hemisuccinate, CHEMS
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C31H50O4 |
| Molecular Weight | 486.3709 g/mol |
| XLogP | 8.5 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 486.3709 Da |
| Heavy Atoms | 35 |
| Complexity | 815.0 |
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCC(=O)O)C)C |
| InChIKey | WLNARFZDISHUGS-MIXBDBMTSA-N |
The XLogP value of 8.5 indicates that Cholesteryl hemisuccinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cholesteryl hemisuccinate. Following Lipinski's Rule of Five, Cholesteryl hemisuccinate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cholesteryl hemisuccinate is 1510-21-0.
The molecular formula of Cholesteryl hemisuccinate is C31H50O4.
The molecular weight of Cholesteryl hemisuccinate is 486.3709 g/mol.
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