Chloramphenicol 3-glucuronide
TL;DR: Chloramphenicol 3-glucuronide (CAS 39751-33-2) is a chemical compound with molecular formula C17H20Cl2N2O11 and molecular weight 498.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-6-[(2R,3R)-2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Chloramphenicol glucuronide, Chloramphenicol 3-glucoronide, Chloramphenicol 3-O-b-D-Glucuronide, Chloramphenicol 3-glucuronide, Chloramphenicol 3-O-
| Molecular Formula | C17H20Cl2N2O11 |
|---|---|
| Molecular Weight | 498.04 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 212.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.0444 |
| Heavy Atoms | 32 |
| Complexity | 671.0 |
Chemical Identifiers
| CAS Number | 39751-33-2 |
|---|---|
| SMILES | C1=CC(=CC=C1[C@H]([C@@H](CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)NC(=O)C(Cl)Cl)O)[N+](=O)[O-] |
| InChIKey | UARPTSDFEIFMJP-PEXHWNMISA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chloramphenicol 3-glucuronide (CAS 39751-33-2), with molecular formula C17H20Cl2N2O11 and molecular weight 498.04 g/mol. IUPAC: (2S,3S,4S,5R,6R)-6-[(2R,3R)-2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of Chloramphenicol 3-glucuronide
Property Insights of Chloramphenicol 3-glucuronide
The XLogP value of -0.4 indicates that Chloramphenicol 3-glucuronide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 212.0 Ų indicates high polarity, suggesting Chloramphenicol 3-glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chloramphenicol 3-glucuronide has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chloramphenicol 3-glucuronide?
The CAS number of Chloramphenicol 3-glucuronide is 39751-33-2.
What is the molecular formula of Chloramphenicol 3-glucuronide?
The molecular formula of Chloramphenicol 3-glucuronide is C17H20Cl2N2O11.
What is the molecular weight of Chloramphenicol 3-glucuronide?
The molecular weight of Chloramphenicol 3-glucuronide is 498.04 g/mol.
Where can I buy Chloramphenicol 3-glucuronide?
You can request a quote for Chloramphenicol 3-glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloramphenicol 3-glucuronide?
Yes, KEHONG BIO provides custom synthesis services for Chloramphenicol 3-glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.