25-Hydroxycholest-5-en-3beta-yl acetate
TL;DR: 25-Hydroxycholest-5-en-3beta-yl acetate (CAS 10525-22-1) 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.
[(3S,8S,9S,10R,13R,14S,17R)-17-[(2R)-6-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
Also Known As: 25-hydroxycholesterol acetate, 25-Hydroxycholest-5-en-3beta-yl acetate, 25-Hydroxycholesterol 3-acetate, Cholest-5-ene-3beta,25-diol 3-acetate, Cholest-5-ene-3,25-diol,3-acetate, (3b)-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H48O3 |
| Molecular Weight | 444.36035 g/mol |
| XLogP | 7.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 444.36035 Da |
| Heavy Atoms | 32 |
| Complexity | 739.0 |
| SMILES | C[C@H](CCCC(C)(C)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C |
| InChIKey | DSBZSDSUGSYUHV-HSIBUNQISA-N |
Chemical Property Profile of 25-Hydroxycholest-5-en-3beta-yl acetate
Property Insights of 25-Hydroxycholest-5-en-3beta-yl acetate
The XLogP value of 7.4 indicates that 25-Hydroxycholest-5-en-3beta-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 25-Hydroxycholest-5-en-3beta-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 25-Hydroxycholest-5-en-3beta-yl acetate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 25-Hydroxycholest-5-en-3beta-yl acetate?
The CAS number of 25-Hydroxycholest-5-en-3beta-yl acetate is 10525-22-1.
What is the molecular formula of 25-Hydroxycholest-5-en-3beta-yl acetate?
The molecular formula of 25-Hydroxycholest-5-en-3beta-yl acetate is C29H48O3.
What is the molecular weight of 25-Hydroxycholest-5-en-3beta-yl acetate?
The molecular weight of 25-Hydroxycholest-5-en-3beta-yl acetate is 444.36035 g/mol.
Where can I buy 25-Hydroxycholest-5-en-3beta-yl acetate?
You can request a quote for 25-Hydroxycholest-5-en-3beta-yl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 25-Hydroxycholest-5-en-3beta-yl acetate?
Yes, CoreyChem provides custom synthesis services for 25-Hydroxycholest-5-en-3beta-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.