红霉素碳酸乙酯
TL;DR: 红霉素碳酸乙酯 (CAS 7218-80-6) is a chemical compound with molecular formula C40H71NO15 and molecular weight 805.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
红霉素碳酸乙酯
[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] ethyl carbonate
Also Known As: Erythromycin, ethyl carbonate, Erythromycin ethylcarbonate, Erythromycin,2'-(ethyl carbonate), Erythromycin, 2a(2)-(ethyl carbonate), 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 ethyl carbonate(non-preferred name)
| Molecular Formula | C40H71NO15 |
|---|---|
| Molecular Weight | 805.48 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 209.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 805.48236 |
| Heavy Atoms | 56 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 7218-80-6 |
|---|---|
| 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)OCC)(C)O)C)C)O)(C)O |
| InChIKey | BSUQCLSFQSUNED-UHFFFAOYSA-N |
Product Overview
红霉素碳酸乙酯 (CAS 7218-80-6), with molecular formula C40H71NO15 and molecular weight 805.48 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] ethyl carbonate.
Chemical Property Profile of 红霉素碳酸乙酯
Property Insights of 红霉素碳酸乙酯
The XLogP value of 4.0 indicates that 红霉素碳酸乙酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 209.0 Ų indicates high polarity, suggesting 红霉素碳酸乙酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 红霉素碳酸乙酯 has 4 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 红霉素碳酸乙酯?
The CAS number of 红霉素碳酸乙酯 is 7218-80-6.
What is the molecular formula of 红霉素碳酸乙酯?
The molecular formula of 红霉素碳酸乙酯 is C40H71NO15.
What is the molecular weight of 红霉素碳酸乙酯?
The molecular weight of 红霉素碳酸乙酯 is 805.48 g/mol.
Where can I buy 红霉素碳酸乙酯?
You can request a quote for 红霉素碳酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 红霉素碳酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 红霉素碳酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.