磺基甘胆酸
TL;DR: 磺基甘胆酸 (CAS 15324-64-8) is a chemical compound with molecular formula C26H43NO7S and molecular weight 513.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磺基甘胆酸
2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-sulfooxy-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: Sulfoglycolithocholic acid, Sulfolithocholylglycine, Glycolithocholic acid 3-sulfate, Sulfolithoglycocholine, Glycine amidated
| Molecular Formula | C26H43NO7S |
|---|---|
| Molecular Weight | 513.28 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 138.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 513.276 |
| Heavy Atoms | 35 |
| Complexity | 917.0 |
Chemical Identifiers
| CAS Number | 15324-64-8 |
|---|---|
| SMILES | C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)C |
| InChIKey | FHXBAFXQVZOILS-OETIFKLTSA-N |
Product Overview
磺基甘胆酸 (CAS 15324-64-8), with molecular formula C26H43NO7S and molecular weight 513.28 g/mol. IUPAC: 2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3-sulfooxy-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 磺基甘胆酸
Property Insights of 磺基甘胆酸
The XLogP value of 5.2 indicates that 磺基甘胆酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 磺基甘胆酸. Following Lipinski's Rule of Five, 磺基甘胆酸 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 磺基甘胆酸?
The CAS number of 磺基甘胆酸 is 15324-64-8.
What is the molecular formula of 磺基甘胆酸?
The molecular formula of 磺基甘胆酸 is C26H43NO7S.
What is the molecular weight of 磺基甘胆酸?
The molecular weight of 磺基甘胆酸 is 513.28 g/mol.
Where can I buy 磺基甘胆酸?
You can request a quote for 磺基甘胆酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 磺基甘胆酸?
Yes, KEHONG BIO provides custom synthesis services for 磺基甘胆酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.