红霉素A烯醇醚
TL;DR: 红霉素A烯醇醚 (CAS 33396-29-1) is a chemical compound with molecular formula C37H65NO12 and molecular weight 715.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
红霉素A烯醇醚
(2R,3R,4S,5R,8R,9S,10S,11R,12R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-ethyl-3,4-dihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-6,15-dioxabicyclo[10.2.1]pentadec-1(14)-en-7-one
Also Known As: Erythromycin A enol ether, Erythromycin enol ether, EM-A enolether, Erythromycin EP Impurity E, EM523L
| Molecular Formula | C37H65NO12 |
|---|---|
| Molecular Weight | 715.45 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 715.4507 |
| Heavy Atoms | 50 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 33396-29-1 |
|---|---|
| SMILES | CC[C@@H]1[C@@]([C@@H]([C@H](C2=C(C[C@@](O2)([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)OC)C)O[C@H]4[C@@H]([C@H](C[C@H](O4)C)N(C)C)O)C)C)C)O)(C)O |
| InChIKey | JFVYXJKGJMUGRG-KJPZRSJGSA-N |
Product Overview
红霉素A烯醇醚 (CAS 33396-29-1), with molecular formula C37H65NO12 and molecular weight 715.45 g/mol. IUPAC: (2R,3R,4S,5R,8R,9S,10S,11R,12R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-5-ethyl-3,4-dihydroxy-9-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4,8,10,12,14-hexamethyl-6,15-dioxabicyclo[10.2.1]pentadec-1(14)-en-7-one.
Chemical Property Profile of 红霉素A烯醇醚
Property Insights of 红霉素A烯醇醚
The XLogP value of 3.3 indicates that 红霉素A烯醇醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.0 Ų indicates high polarity, suggesting 红霉素A烯醇醚 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 红霉素A烯醇醚 has 4 hydrogen bond donor(s) and 13 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A烯醇醚?
The CAS number of 红霉素A烯醇醚 is 33396-29-1.
What is the molecular formula of 红霉素A烯醇醚?
The molecular formula of 红霉素A烯醇醚 is C37H65NO12.
What is the molecular weight of 红霉素A烯醇醚?
The molecular weight of 红霉素A烯醇醚 is 715.45 g/mol.
Where can I buy 红霉素A烯醇醚?
You can request a quote for 红霉素A烯醇醚 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A烯醇醚?
Yes, KEHONG BIO provides custom synthesis services for 红霉素A烯醇醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.