26-Nor-25-doxylcholestanol
TL;DR: 26-Nor-25-doxylcholestanol (CAS 96203-22-4) is a chemical compound with molecular formula C30H52NO3- and molecular weight 474.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5-(2,4,4-trimethyl-3-oxido-1,3-oxazolidin-2-yl)pentan-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: 26-Dco, 26-Nor-25-doxylcholestanol, (3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5-(2,4,4-trimethyl-3-oxido-1,3-oxazolidin-2-yl)pentan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol, 3-Oxazolidinyloxy, 2-((3beta,5alpha)-3-hydroxycholan-24-yl)-2,4,4-trimethyl-, (R)-, 2-(3-Hydroxycholan-24-yl)-2,4,4-trimethyl-1,3-oxazolidin-3-olate
| Molecular Formula | C30H52NO3- |
|---|---|
| Molecular Weight | 474.39 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.3947 |
| Heavy Atoms | 34 |
| Complexity | 755.0 |
Chemical Identifiers
| CAS Number | 96203-22-4 |
|---|---|
| SMILES | C[C@H](CCCC1(N(C(CO1)(C)C)[O-])C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC[C@@H]5[C@@]4(CC[C@@H](C5)O)C)C |
| InChIKey | FFRJSKDVDFPYMM-KYQYSKTRSA-N |
Product Overview
26-Nor-25-doxylcholestanol (CAS 96203-22-4), with molecular formula C30H52NO3- and molecular weight 474.39 g/mol. IUPAC: (3S,5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-5-(2,4,4-trimethyl-3-oxido-1,3-oxazolidin-2-yl)pentan-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 26-Nor-25-doxylcholestanol
Property Insights of 26-Nor-25-doxylcholestanol
The XLogP value of 7.7 indicates that 26-Nor-25-doxylcholestanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 26-Nor-25-doxylcholestanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 26-Nor-25-doxylcholestanol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 26-Nor-25-doxylcholestanol?
The CAS number of 26-Nor-25-doxylcholestanol is 96203-22-4.
What is the molecular formula of 26-Nor-25-doxylcholestanol?
The molecular formula of 26-Nor-25-doxylcholestanol is C30H52NO3-.
What is the molecular weight of 26-Nor-25-doxylcholestanol?
The molecular weight of 26-Nor-25-doxylcholestanol is 474.39 g/mol.
Where can I buy 26-Nor-25-doxylcholestanol?
You can request a quote for 26-Nor-25-doxylcholestanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 26-Nor-25-doxylcholestanol?
Yes, KEHONG BIO provides custom synthesis services for 26-Nor-25-doxylcholestanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.