甘氨熊去氧胆酸
TL;DR: 甘氨熊去氧胆酸 (CAS 64480-66-6) 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.
甘氨熊去氧胆酸
2-[4-(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)pentanoylamino]acetic acid
Also Known As: Glycoursodeoxycholic acid, Glycochenodeoxycholate, Ursodeoxycholylglycine, Chenodeoxycholylglycine, GLYCOCHENODEOXYCHOLIC ACID
| 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 |
Chemical Identifiers
| CAS Number | 64480-66-6 |
|---|---|
| SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C |
| InChIKey | GHCZAUBVMUEKKP-UHFFFAOYSA-N |
Product Overview
甘氨熊去氧胆酸 (CAS 64480-66-6), with molecular formula C26H43NO5 and molecular weight 449.31 g/mol. IUPAC: 2-[4-(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)pentanoylamino]acetic acid.
Chemical Property Profile of 甘氨熊去氧胆酸
Property Insights of 甘氨熊去氧胆酸
The XLogP value of 4.3 indicates that 甘氨熊去氧胆酸 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 甘氨熊去氧胆酸. Following Lipinski's Rule of Five, 甘氨熊去氧胆酸 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 甘氨熊去氧胆酸?
The CAS number of 甘氨熊去氧胆酸 is 64480-66-6.
What is the molecular formula of 甘氨熊去氧胆酸?
The molecular formula of 甘氨熊去氧胆酸 is C26H43NO5.
What is the molecular weight of 甘氨熊去氧胆酸?
The molecular weight of 甘氨熊去氧胆酸 is 449.31 g/mol.
Where can I buy 甘氨熊去氧胆酸?
You can request a quote for 甘氨熊去氧胆酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甘氨熊去氧胆酸?
Yes, KEHONG BIO provides custom synthesis services for 甘氨熊去氧胆酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.