26-羟基胆固醇二硫酸酯
TL;DR: 26-羟基胆固醇二硫酸酯 (CAS 107241-08-7) is a chemical compound with molecular formula C27H46O8S2 and molecular weight 562.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
26-羟基胆固醇二硫酸酯
[(8S,9S,10R,13R,14S,17S)-10,13-dimethyl-17-[(2R)-6-methyl-7-sulfooxyheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate
Also Known As: 26-Hydroxycholesterol disulfate, Cholest-5-ene-3,26-diyl bis(hydrogen sulfate), [(8S,9S,10R,13R,14S,17S)-10,13-dimethyl-17-[(2R)-6-methyl-7-sulfooxyheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate, 17alpha-Cholest-5-ene-3,26-diyl bis(hydrogen sulfate), RefChem:89948
| Molecular Formula | C27H46O8S2 |
|---|---|
| Molecular Weight | 562.26 g/mol |
| LogP | 6.4 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 562.2634 |
| Heavy Atoms | 37 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 107241-08-7 |
|---|---|
| SMILES | C[C@H](CCCC(C)COS(=O)(=O)O)[C@@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CCC(C4)OS(=O)(=O)O)C)C |
| InChIKey | CKKZPKHJVOCGKH-CYWZQEKTSA-N |
Product Overview
26-羟基胆固醇二硫酸酯 (CAS 107241-08-7), with molecular formula C27H46O8S2 and molecular weight 562.26 g/mol. IUPAC: [(8S,9S,10R,13R,14S,17S)-10,13-dimethyl-17-[(2R)-6-methyl-7-sulfooxyheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate.
Chemical Property Profile of 26-羟基胆固醇二硫酸酯
Property Insights of 26-羟基胆固醇二硫酸酯
The XLogP value of 6.4 indicates that 26-羟基胆固醇二硫酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.0 Ų indicates high polarity, suggesting 26-羟基胆固醇二硫酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 26-羟基胆固醇二硫酸酯 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 26-羟基胆固醇二硫酸酯?
The CAS number of 26-羟基胆固醇二硫酸酯 is 107241-08-7.
What is the molecular formula of 26-羟基胆固醇二硫酸酯?
The molecular formula of 26-羟基胆固醇二硫酸酯 is C27H46O8S2.
What is the molecular weight of 26-羟基胆固醇二硫酸酯?
The molecular weight of 26-羟基胆固醇二硫酸酯 is 562.26 g/mol.
Where can I buy 26-羟基胆固醇二硫酸酯?
You can request a quote for 26-羟基胆固醇二硫酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 26-羟基胆固醇二硫酸酯?
Yes, KEHONG BIO provides custom synthesis services for 26-羟基胆固醇二硫酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.