9-Deoxo-9a-aza-9a-homoerythromycin A
TL;DR: 9-Deoxo-9a-aza-9a-homoerythromycin A (CAS 76801-85-9) is a chemical compound with molecular formula C37H70N2O12 and molecular weight 734.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadecan-15-one
Also Known As: Azathramycin, Azaerythromycin A, Azaerythromycin, DD-Azaerythromycin A, Azahomoerythromycin
| Molecular Formula | C37H70N2O12 |
|---|---|
| Molecular Weight | 734.49 g/mol |
| LogP | 1.5585 |
| Topological Polar Surface Area | 188.87 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 734.49286 |
| Heavy Atoms | 51 |
| Complexity | 1111.4337 |
Chemical Identifiers
| CAS Number | 76801-85-9 |
|---|---|
| SMILES | CC[C@@H]1[C@@]([C@@H]([C@H](NC[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O |
Product Overview
9-Deoxo-9a-aza-9a-homoerythromycin A (CAS 76801-85-9), with molecular formula C37H70N2O12 and molecular weight 734.49 g/mol. IUPAC: (2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-11-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadecan-15-one.
Chemical Property Profile of 9-Deoxo-9a-aza-9a-homoerythromycin A
Property Insights of 9-Deoxo-9a-aza-9a-homoerythromycin A
The XLogP value of 1.5585 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Deoxo-9a-aza-9a-homoerythromycin A. The TPSA of 188.87 Ų indicates high polarity, suggesting 9-Deoxo-9a-aza-9a-homoerythromycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-Deoxo-9a-aza-9a-homoerythromycin A has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-Deoxo-9a-aza-9a-homoerythromycin A?
The CAS number of 9-Deoxo-9a-aza-9a-homoerythromycin A is 76801-85-9.
What is the molecular formula of 9-Deoxo-9a-aza-9a-homoerythromycin A?
The molecular formula of 9-Deoxo-9a-aza-9a-homoerythromycin A is C37H70N2O12.
What is the molecular weight of 9-Deoxo-9a-aza-9a-homoerythromycin A?
The molecular weight of 9-Deoxo-9a-aza-9a-homoerythromycin A is 734.49 g/mol.
Where can I buy 9-Deoxo-9a-aza-9a-homoerythromycin A?
You can request a quote for 9-Deoxo-9a-aza-9a-homoerythromycin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Deoxo-9a-aza-9a-homoerythromycin A?
Yes, KEHONG BIO provides custom synthesis services for 9-Deoxo-9a-aza-9a-homoerythromycin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.