Erythromycin, 2'-(5-nitro-2-furancarboxylate)
TL;DR: Erythromycin, 2'-(5-nitro-2-furancarboxylate) (CAS 60847-76-9) is a chemical compound with molecular formula C42H68N2O17 and molecular weight 872.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(dimethylamino)-2-[[14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-6-methyloxan-3-yl] 5-nitrofuran-2-carboxylate
Also Known As: Erythromycin, 2'-(5-nitro-2-furancarboxylate), 2-Cladinosyl-5-(2'-O-(5-nitro-2-furoyl))desoaminylerythronolide A, Erythromycin, 2a(2)-(5-nitro-2-furancarboxylate), ERYTHROMYCIN 2'-(5-NITRO-2-FURANCARBOXYLATE), 4-(dimethylamino)-2-({14-ethyl-7,12,13-trihydroxy-4-[(5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2h-pyran-2-yl)oxy]-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl}oxy)-6-methyltetrahydro-2h-pyran-3-yl 5-nitrofuran-2-carboxylate(non-preferred name)
| Molecular Formula | C42H68N2O17 |
|---|---|
| Molecular Weight | 872.45 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 872.4518 |
| Heavy Atoms | 61 |
| Complexity | 1530.0 |
Chemical Identifiers
| CAS Number | 60847-76-9 |
|---|---|
| SMILES | CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)OC(=O)C4=CC=C(O4)[N+](=O)[O-])(C)O)C)C)O)(C)O |
| InChIKey | WKEYAKSXZNFQEW-UHFFFAOYSA-N |
Product Overview
Erythromycin, 2'-(5-nitro-2-furancarboxylate) (CAS 60847-76-9), with molecular formula C42H68N2O17 and molecular weight 872.45 g/mol. IUPAC: [4-(dimethylamino)-2-[[14-ethyl-7,12,13-trihydroxy-4-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-6-methyloxan-3-yl] 5-nitrofuran-2-carboxylate.
Chemical Property Profile of Erythromycin, 2'-(5-nitro-2-furancarboxylate)
Property Insights of Erythromycin, 2'-(5-nitro-2-furancarboxylate)
The XLogP value of 4.5 indicates that Erythromycin, 2'-(5-nitro-2-furancarboxylate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 259.0 Ų indicates high polarity, suggesting Erythromycin, 2'-(5-nitro-2-furancarboxylate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Erythromycin, 2'-(5-nitro-2-furancarboxylate) has 4 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Erythromycin, 2'-(5-nitro-2-furancarboxylate)?
The CAS number of Erythromycin, 2'-(5-nitro-2-furancarboxylate) is 60847-76-9.
What is the molecular formula of Erythromycin, 2'-(5-nitro-2-furancarboxylate)?
The molecular formula of Erythromycin, 2'-(5-nitro-2-furancarboxylate) is C42H68N2O17.
What is the molecular weight of Erythromycin, 2'-(5-nitro-2-furancarboxylate)?
The molecular weight of Erythromycin, 2'-(5-nitro-2-furancarboxylate) is 872.45 g/mol.
Where can I buy Erythromycin, 2'-(5-nitro-2-furancarboxylate)?
You can request a quote for Erythromycin, 2'-(5-nitro-2-furancarboxylate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erythromycin, 2'-(5-nitro-2-furancarboxylate)?
Yes, KEHONG BIO provides custom synthesis services for Erythromycin, 2'-(5-nitro-2-furancarboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.