Codeine-6-glucuronide
TL;DR: Codeine-6-glucuronide (CAS 219533-59-2) is a chemical compound with molecular formula C24H29NO9 and molecular weight 475.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Codeine-6-glucuronide, codeine glucuronide, Codeine-6G, Codeine 6-glucuronide, Codeine 6-beta-D-Glucuronide
| Molecular Formula | C24H29NO9 |
|---|---|
| Molecular Weight | 475.18 g/mol |
| LogP | -0.5824 |
| Topological Polar Surface Area | 138.15 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 475.18423 |
| Heavy Atoms | 34 |
| Complexity | 1045.5151 |
Chemical Identifiers
| CAS Number | 219533-59-2 |
|---|---|
| SMILES | CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)C(=O)O)O)O)O |
Product Overview
Codeine-6-glucuronide (CAS 219533-59-2), with molecular formula C24H29NO9 and molecular weight 475.18 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of Codeine-6-glucuronide
Property Insights of Codeine-6-glucuronide
The XLogP value of -0.5824 indicates that Codeine-6-glucuronide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 138.15 Ų falls within the moderate polarity range, balancing permeability and solubility for Codeine-6-glucuronide. Following Lipinski's Rule of Five, Codeine-6-glucuronide has 4 hydrogen bond donor(s) and 9 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 Codeine-6-glucuronide?
The CAS number of Codeine-6-glucuronide is 219533-59-2.
What is the molecular formula of Codeine-6-glucuronide?
The molecular formula of Codeine-6-glucuronide is C24H29NO9.
What is the molecular weight of Codeine-6-glucuronide?
The molecular weight of Codeine-6-glucuronide is 475.18 g/mol.
Where can I buy Codeine-6-glucuronide?
You can request a quote for Codeine-6-glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Codeine-6-glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Codeine-6-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.