Sterolibrin
TL;DR: Sterolibrin (CAS 8077-77-8) is a chemical compound with molecular formula C45H55ClO6 and molecular weight 726.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-16-methylidene-3-oxo-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
Also Known As: Sterolibrin, Biogest, [(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-16-methylidene-3-oxo-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol, Pregna-4,6-diene-3,20-dione, 17-(acetyloxy)-6-chloro-16-methylene-, mixt. with (17alpha)-3-methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17-ol, [(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-16-methylidene-3-oxo-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate; (8R,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol
| Molecular Formula | C45H55ClO6 |
|---|---|
| Molecular Weight | 726.37 g/mol |
| LogP | 8.8334 |
| Topological Polar Surface Area | 89.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 726.3687 |
| Heavy Atoms | 52 |
| Complexity | 1833.8723 |
Chemical Identifiers
| CAS Number | 8077-77-8 |
|---|---|
| SMILES | CC(=O)[C@]1(C(=C)C[C@@H]2[C@@]1(CC[C@H]3[C@H]2C=C(C4=CC(=O)CC[C@]34C)Cl)C)OC(=O)C.C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2(C#C)O)CCC4=C3C=CC(=C4)OC |
Product Overview
Sterolibrin (CAS 8077-77-8), with molecular formula C45H55ClO6 and molecular weight 726.37 g/mol. IUPAC: [(8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-16-methylidene-3-oxo-1,2,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl] acetate;(8R,9S,13S,14S)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol.
Chemical Property Profile of Sterolibrin
Property Insights of Sterolibrin
The XLogP value of 8.8334 indicates that Sterolibrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Sterolibrin. Following Lipinski's Rule of Five, Sterolibrin has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sterolibrin?
The CAS number of Sterolibrin is 8077-77-8.
What is the molecular formula of Sterolibrin?
The molecular formula of Sterolibrin is C45H55ClO6.
What is the molecular weight of Sterolibrin?
The molecular weight of Sterolibrin is 726.37 g/mol.
Where can I buy Sterolibrin?
You can request a quote for Sterolibrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sterolibrin?
Yes, KEHONG BIO provides custom synthesis services for Sterolibrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.