Erythromycin Stinoprate
TL;DR: Erythromycin Stinoprate (CAS 84252-03-9) is a chemical compound with molecular formula C45H80N2O17S and molecular weight 952.52 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-3-sulfanylpropanoic acid;[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-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] propanoate
Also Known As: Erythromycin stinoprate, Erysec, Erythromycini stinopras, Erysec (TN), Erythromycinstinoprat
| Molecular Formula | C45H80N2O17S |
|---|---|
| Molecular Weight | 952.52 g/mol |
| LogP | 2.25 |
| Topological Polar Surface Area | 267.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 13 |
| Exact Mass | 952.51776 |
| Heavy Atoms | 65 |
| Complexity | 1450.0 |
Chemical Identifiers
| CAS Number | 84252-03-9 |
|---|---|
| SMILES | CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[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)OC(=O)CC)(C)O)C)C)O)(C)O.CC(=O)N[C@@H](CS)C(=O)O |
| InChIKey | HXKNXCFNAJGZCM-PWOIWMLJSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Erythromycin Stinoprate (CAS 84252-03-9), with molecular formula C45H80N2O17S and molecular weight 952.52 g/mol. IUPAC: (2R)-2-acetamido-3-sulfanylpropanoic acid;[(2S,3R,4S,6R)-4-(dimethylamino)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-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] propanoate.
Chemical Property Profile of Erythromycin Stinoprate
Property Insights of Erythromycin Stinoprate
The XLogP value of 2.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Erythromycin Stinoprate. The TPSA of 267.0 Ų indicates high polarity, suggesting Erythromycin Stinoprate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Erythromycin Stinoprate has 7 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Erythromycin Stinoprate?
The CAS number of Erythromycin Stinoprate is 84252-03-9.
What is the molecular formula of Erythromycin Stinoprate?
The molecular formula of Erythromycin Stinoprate is C45H80N2O17S.
What is the molecular weight of Erythromycin Stinoprate?
The molecular weight of Erythromycin Stinoprate is 952.52 g/mol.
Where can I buy Erythromycin Stinoprate?
You can request a quote for Erythromycin Stinoprate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erythromycin Stinoprate?
Yes, KEHONG BIO provides custom synthesis services for Erythromycin Stinoprate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.