7-酮脱氧胆酸
TL;DR: 7-酮脱氧胆酸 (CAS 911-40-0) is a chemical compound with molecular formula C24H38O5 and molecular weight 406.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-酮脱氧胆酸
4-(3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid
Also Known As: 7-Ketodeoxycholic acid, 7-Cheto-deoxycholic acid, 3,12-Dihydroxy-7-oxocholan-24-oic acid, 7-Keto-3a,12-a-dihydroxycholanic Acid, A-Cholanic Acid-3
| Molecular Formula | C24H38O5 |
|---|---|
| Molecular Weight | 406.27 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.2719 |
| Heavy Atoms | 29 |
| Complexity | 676.0 |
Chemical Identifiers
| CAS Number | 911-40-0 |
|---|---|
| SMILES | CC(CCC(=O)O)C1CCC2C1(C(CC3C2C(=O)CC4C3(CCC(C4)O)C)O)C |
| InChIKey | RHCPKKNRWFXMAT-UHFFFAOYSA-N |
Product Overview
7-酮脱氧胆酸 (CAS 911-40-0), with molecular formula C24H38O5 and molecular weight 406.27 g/mol. IUPAC: 4-(3,12-dihydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)pentanoic acid.
Chemical Property Profile of 7-酮脱氧胆酸
Property Insights of 7-酮脱氧胆酸
The XLogP value of 3.3 indicates that 7-酮脱氧胆酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-酮脱氧胆酸. Following Lipinski's Rule of Five, 7-酮脱氧胆酸 has 3 hydrogen bond donor(s) and 5 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 7-酮脱氧胆酸?
The CAS number of 7-酮脱氧胆酸 is 911-40-0.
What is the molecular formula of 7-酮脱氧胆酸?
The molecular formula of 7-酮脱氧胆酸 is C24H38O5.
What is the molecular weight of 7-酮脱氧胆酸?
The molecular weight of 7-酮脱氧胆酸 is 406.27 g/mol.
Where can I buy 7-酮脱氧胆酸?
You can request a quote for 7-酮脱氧胆酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-酮脱氧胆酸?
Yes, KEHONG BIO provides custom synthesis services for 7-酮脱氧胆酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.