3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid
TL;DR: 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid (CAS 140852-41-1) is a chemical compound with molecular formula C24H40O6 and molecular weight 424.2825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4R)-4-[(3R,5R,6S,7R,8R,9S,10R,12R,13R,14S,17R)-3,6,7,12-tetrahydroxy-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: 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid, 3a,6b,7b,12b-Tetrahydroxy-5b-cholanoate, 3a,6b,7b,12b-Tetrahydroxy-5b-cholanoic acid, -3,6,7,12-tetrahydroxy-Cholan-24-oicacid, 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholanoic Acid
Technical Specifications
| Molecular Formula | C24H40O6 |
| Molecular Weight | 424.2825 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 424.2825 Da |
| Heavy Atoms | 30 |
| Complexity | 668.0 |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@@H](C[C@H]3[C@H]2[C@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)O)C |
| InChIKey | COCMFMBNEAMQMA-XEGXWRQYSA-N |
Chemical Property Profile of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid
Property Insights of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid. Following Lipinski's Rule of Five, 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid?
The CAS number of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid is 140852-41-1.
What is the molecular formula of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid?
The molecular formula of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid is C24H40O6.
What is the molecular weight of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid?
The molecular weight of 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid is 424.2825 g/mol.
Where can I buy 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid?
You can request a quote for 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid?
Yes, CoreyChem provides custom synthesis services for 3alpha,6beta,7beta,12beta-Tetrahydroxy-5beta-cholan-24-oic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.