胆甾醇酯氢过氧化物
TL;DR: 胆甾醇酯氢过氧化物 (CAS 23564-90-1) is a chemical compound with molecular formula C27H46O2 and molecular weight 402.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
胆甾醇酯氢过氧化物
(3S,8S,9S,10R,13R,14S,17R)-3-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene
Also Known As: CE-Ooh, Cholesteryl ester hydroperoxide, Cholest-5-ene-3-peroxol, Cholest-5-ene-3beta-peroxol, 3beta-(Hydroperoxy)cholesta-5-ene
| Molecular Formula | C27H46O2 |
|---|---|
| Molecular Weight | 402.35 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.3498 |
| Heavy Atoms | 29 |
| Complexity | 610.0 |
Chemical Identifiers
| CAS Number | 23564-90-1 |
|---|---|
| SMILES | C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OO)C)C |
| InChIKey | JMMMHJWHJMBHOK-DPAQBDIFSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
胆甾醇酯氢过氧化物 (CAS 23564-90-1), with molecular formula C27H46O2 and molecular weight 402.35 g/mol. IUPAC: (3S,8S,9S,10R,13R,14S,17R)-3-hydroperoxy-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene.
Chemical Property Profile of 胆甾醇酯氢过氧化物
Property Insights of 胆甾醇酯氢过氧化物
The XLogP value of 8.6 indicates that 胆甾醇酯氢过氧化物 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 胆甾醇酯氢过氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 胆甾醇酯氢过氧化物 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 胆甾醇酯氢过氧化物?
The CAS number of 胆甾醇酯氢过氧化物 is 23564-90-1.
What is the molecular formula of 胆甾醇酯氢过氧化物?
The molecular formula of 胆甾醇酯氢过氧化物 is C27H46O2.
What is the molecular weight of 胆甾醇酯氢过氧化物?
The molecular weight of 胆甾醇酯氢过氧化物 is 402.35 g/mol.
Where can I buy 胆甾醇酯氢过氧化物?
You can request a quote for 胆甾醇酯氢过氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 胆甾醇酯氢过氧化物?
Yes, KEHONG BIO provides custom synthesis services for 胆甾醇酯氢过氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.