20-Hydroperoxycholesterol
TL;DR: 20-Hydroperoxycholesterol (CAS 23653-01-2) is a chemical compound with molecular formula C27H46O3 and molecular weight 418.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,8S,9S,10R,13S,14S,17S)-17-[(2S)-2-hydroperoxy-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-ol
Also Known As: 20-Hydroperoxycholesterol, APBO, Cholesterol-20-hydroperoxide, 20alpha-Hydroperixycholesterol, 20-hydroperoxycholest-5-en-3beta-ol
| Molecular Formula | C27H46O3 |
|---|---|
| Molecular Weight | 418.34 g/mol |
| LogP | 7.0009 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.3447 |
| Heavy Atoms | 30 |
| Complexity | 656.4936 |
Chemical Identifiers
| CAS Number | 23653-01-2 |
|---|---|
| SMILES | CC(C)CCC[C@@](C)([C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)OO |
Product Overview
20-Hydroperoxycholesterol (CAS 23653-01-2), with molecular formula C27H46O3 and molecular weight 418.34 g/mol. IUPAC: (3S,8S,9S,10R,13S,14S,17S)-17-[(2S)-2-hydroperoxy-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-ol.
Chemical Property Profile of 20-Hydroperoxycholesterol
Property Insights of 20-Hydroperoxycholesterol
The XLogP value of 7.0009 indicates that 20-Hydroperoxycholesterol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.69 Ų, 20-Hydroperoxycholesterol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 20-Hydroperoxycholesterol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 20-Hydroperoxycholesterol?
The CAS number of 20-Hydroperoxycholesterol is 23653-01-2.
What is the molecular formula of 20-Hydroperoxycholesterol?
The molecular formula of 20-Hydroperoxycholesterol is C27H46O3.
What is the molecular weight of 20-Hydroperoxycholesterol?
The molecular weight of 20-Hydroperoxycholesterol is 418.34 g/mol.
Where can I buy 20-Hydroperoxycholesterol?
You can request a quote for 20-Hydroperoxycholesterol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 20-Hydroperoxycholesterol?
Yes, KEHONG BIO provides custom synthesis services for 20-Hydroperoxycholesterol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.