Lithocholylglycine
TL;DR: Lithocholylglycine (CAS 79252-50-9) is a chemical compound with molecular formula C26H43NO4 and molecular weight 433.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid
Also Known As: Lithocholylglycine, Glycolithocholic acid, Glycolithocholic acid-d4, Glycolithocholic acid,sodium salt, 2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-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
| Molecular Formula | C26H43NO4 |
|---|---|
| Molecular Weight | 433.32 g/mol |
| LogP | 4.6233 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 433.3192 |
| Heavy Atoms | 31 |
| Complexity | 694.8945 |
Chemical Identifiers
| CAS Number | 79252-50-9 |
|---|---|
| SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C |
Product Overview
Lithocholylglycine (CAS 79252-50-9), with molecular formula C26H43NO4 and molecular weight 433.32 g/mol. IUPAC: 2-[4-(3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]acetic acid.
Chemical Property Profile of Lithocholylglycine
Property Insights of Lithocholylglycine
The XLogP value of 4.6233 indicates that Lithocholylglycine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Lithocholylglycine. Following Lipinski's Rule of Five, Lithocholylglycine 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 Lithocholylglycine?
The CAS number of Lithocholylglycine is 79252-50-9.
What is the molecular formula of Lithocholylglycine?
The molecular formula of Lithocholylglycine is C26H43NO4.
What is the molecular weight of Lithocholylglycine?
The molecular weight of Lithocholylglycine is 433.32 g/mol.
Where can I buy Lithocholylglycine?
You can request a quote for Lithocholylglycine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lithocholylglycine?
Yes, KEHONG BIO provides custom synthesis services for Lithocholylglycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.