表二氢胆甾醇
TL;DR: 表二氢胆甾醇 (CAS 516-95-0) is a chemical compound with molecular formula C27H48O and molecular weight 388.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
表二氢胆甾醇
(3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Also Known As: Epicholestanol, epidihydrocholesterin, epi-Cholestanol, Presteron, Epidehydrocholesterin
| Molecular Formula | C27H48O |
|---|---|
| Molecular Weight | 388.37 g/mol |
| LogP | 9.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.3705 |
| Heavy Atoms | 28 |
| Complexity | 540.0 |
| Melting Point | 113 - 114 °C |
Chemical Identifiers
| CAS Number | 516-95-0 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C |
| InChIKey | QYIXCDOBOSTCEI-FBVYSKEZSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
表二氢胆甾醇 (CAS 516-95-0), with molecular formula C27H48O and molecular weight 388.37 g/mol. IUPAC: (3R,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol.
Chemical Property Profile of 表二氢胆甾醇
Property Insights of 表二氢胆甾醇
The XLogP value of 9.4 indicates that 表二氢胆甾醇 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 表二氢胆甾醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 表二氢胆甾醇 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 表二氢胆甾醇?
The CAS number of 表二氢胆甾醇 is 516-95-0.
What is the molecular formula of 表二氢胆甾醇?
The molecular formula of 表二氢胆甾醇 is C27H48O.
What is the molecular weight of 表二氢胆甾醇?
The molecular weight of 表二氢胆甾醇 is 388.37 g/mol.
Where can I buy 表二氢胆甾醇?
You can request a quote for 表二氢胆甾醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 表二氢胆甾醇?
Yes, KEHONG BIO provides custom synthesis services for 表二氢胆甾醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.