Murideoxycholic acid
TL;DR: Murideoxycholic acid (CAS 668-49-5) is a chemical compound with molecular formula C24H40O4 and molecular weight 392.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4R)-4-[(3R,5R,6R,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Also Known As: Murideoxycholic acid, Murocholic acid, Murideoxycholate, Murocholate, MDCA
| Molecular Formula | C24H40O4 |
|---|---|
| Molecular Weight | 392.29 g/mol |
| LogP | 4.4779 |
| Topological Polar Surface Area | 77.76 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.29266 |
| Heavy Atoms | 28 |
| Complexity | 605.4126 |
Chemical Identifiers
| CAS Number | 668-49-5 |
|---|---|
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
Product Overview
Murideoxycholic acid (CAS 668-49-5), with molecular formula C24H40O4 and molecular weight 392.29 g/mol. IUPAC: (4R)-4-[(3R,5R,6R,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid.
Chemical Property Profile of Murideoxycholic acid
Property Insights of Murideoxycholic acid
The XLogP value of 4.4779 indicates that Murideoxycholic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Murideoxycholic acid. Following Lipinski's Rule of Five, Murideoxycholic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Murideoxycholic acid?
The CAS number of Murideoxycholic acid is 668-49-5.
What is the molecular formula of Murideoxycholic acid?
The molecular formula of Murideoxycholic acid is C24H40O4.
What is the molecular weight of Murideoxycholic acid?
The molecular weight of Murideoxycholic acid is 392.29 g/mol.
Where can I buy Murideoxycholic acid?
You can request a quote for Murideoxycholic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Murideoxycholic acid?
Yes, KEHONG BIO provides custom synthesis services for Murideoxycholic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.