Glycochenodeoxycholic Acid
TL;DR: Glycochenodeoxycholic Acid (CAS 640-79-9) is a chemical compound with molecular formula C26H43NO5 and molecular weight 449.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(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]pentanoyl]amino]acetic acid
Also Known As: GLYCOCHENODEOXYCHOLIC ACID, Glycochenodeoxycholate, Chenodeoxycholylglycine, GCDCA, Glycine chenodeoxycholate
| Molecular Formula | C26H43NO5 |
|---|---|
| Molecular Weight | 449.31 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 449.31412 |
| Heavy Atoms | 32 |
| Complexity | 727.0 |
| Solubility | 3.15 |
Chemical Identifiers
| CAS Number | 640-79-9 |
|---|---|
| SMILES | C[C@H](CCC(=O)NCC(=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 | GHCZAUBVMUEKKP-GYPHWSFCSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Glycochenodeoxycholic Acid (CAS 640-79-9), with molecular formula C26H43NO5 and molecular weight 449.31 g/mol. IUPAC: 2-[[(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]pentanoyl]amino]acetic acid.
Chemical Property Profile of Glycochenodeoxycholic Acid
Property Insights of Glycochenodeoxycholic Acid
The XLogP value of 4.3 indicates that Glycochenodeoxycholic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycochenodeoxycholic Acid. Following Lipinski's Rule of Five, Glycochenodeoxycholic Acid has 4 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 Glycochenodeoxycholic Acid?
The CAS number of Glycochenodeoxycholic Acid is 640-79-9.
What is the molecular formula of Glycochenodeoxycholic Acid?
The molecular formula of Glycochenodeoxycholic Acid is C26H43NO5.
What is the molecular weight of Glycochenodeoxycholic Acid?
The molecular weight of Glycochenodeoxycholic Acid is 449.31 g/mol.
Where can I buy Glycochenodeoxycholic Acid?
You can request a quote for Glycochenodeoxycholic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycochenodeoxycholic Acid?
Yes, KEHONG BIO provides custom synthesis services for Glycochenodeoxycholic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.