鹅去氧胆酸
TL;DR: 鹅去氧胆酸 (CAS 474-25-9) 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.
鹅去氧胆酸
(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-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: chenodeoxycholic acid, Chenodiol, Chenix, Cdca, Chenic acid
| Molecular Formula | C24H40O4 |
|---|---|
| Molecular Weight | 392.29 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 392.29266 |
| Heavy Atoms | 28 |
| Complexity | 605.0 |
| Melting Point | 168-171 |
| Solubility | 89.9 |
Chemical Identifiers
| CAS Number | 474-25-9 |
|---|---|
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
| InChIKey | RUDATBOHQWOJDD-BSWAIDMHSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
鹅去氧胆酸 (CAS 474-25-9), with molecular formula C24H40O4 and molecular weight 392.29 g/mol. IUPAC: (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-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 鹅去氧胆酸
Property Insights of 鹅去氧胆酸
The XLogP value of 4.9 indicates that 鹅去氧胆酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 鹅去氧胆酸. Following Lipinski's Rule of Five, 鹅去氧胆酸 has 3 hydrogen bond donor(s) and 4 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 鹅去氧胆酸?
The CAS number of 鹅去氧胆酸 is 474-25-9.
What is the molecular formula of 鹅去氧胆酸?
The molecular formula of 鹅去氧胆酸 is C24H40O4.
What is the molecular weight of 鹅去氧胆酸?
The molecular weight of 鹅去氧胆酸 is 392.29 g/mol.
Where can I buy 鹅去氧胆酸?
You can request a quote for 鹅去氧胆酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鹅去氧胆酸?
Yes, KEHONG BIO provides custom synthesis services for 鹅去氧胆酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.