Cholestanone
TL;DR: Cholestanone (CAS 26264-62-0) is a chemical compound with molecular formula C27H46O and molecular weight 386.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8R,9S,10S,13R,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Also Known As: Cholestanone, 3-Oxocholestane, ERK5-6I03, (8R,9S,10S,13R,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C27H46O |
|---|---|
| Molecular Weight | 386.35 g/mol |
| LogP | 8.9 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.35486 |
| Heavy Atoms | 28 |
| Complexity | 579.0 |
Chemical Identifiers
| CAS Number | 26264-62-0 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)C1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4[C@@]3(CCC(=O)C4)C)C |
| InChIKey | PESKGJQREUXSRR-FFVPDYPRSA-N |
Product Overview
Cholestanone (CAS 26264-62-0), with molecular formula C27H46O and molecular weight 386.35 g/mol. IUPAC: (8R,9S,10S,13R,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Cholestanone
Property Insights of Cholestanone
The XLogP value of 8.9 indicates that Cholestanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Cholestanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cholestanone has 0 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 Cholestanone?
The CAS number of Cholestanone is 26264-62-0.
What is the molecular formula of Cholestanone?
The molecular formula of Cholestanone is C27H46O.
What is the molecular weight of Cholestanone?
The molecular weight of Cholestanone is 386.35 g/mol.
Where can I buy Cholestanone?
You can request a quote for Cholestanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cholestanone?
Yes, KEHONG BIO provides custom synthesis services for Cholestanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.