Erythromycin Thiocyanate
TL;DR: Erythromycin Thiocyanate (CAS 7704-67-8) is a chemical compound with molecular formula C38H68N2O13S and molecular weight 792.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-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-oxacyclotetradecane-2,10-dione;thiocyanic acid
Also Known As: Erythromycin thiocyanate, null, Gallimycin, Erythrocin (TN), ERYTROVET
| Molecular Formula | C38H68N2O13S |
|---|---|
| Molecular Weight | 792.44 g/mol |
| LogP | 2.18 |
| Topological Polar Surface Area | 219.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 792.4442 |
| Heavy Atoms | 54 |
| Complexity | 1210.0 |
Chemical Identifiers
| CAS Number | 7704-67-8 |
|---|---|
| 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)O)(C)O)C)C)O)(C)O.C(#N)S |
| InChIKey | WVRRTEYLDPNZHR-YZPBMOCRSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Erythromycin Thiocyanate (CAS 7704-67-8), with molecular formula C38H68N2O13S and molecular weight 792.44 g/mol. IUPAC: (3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-6-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-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-oxacyclotetradecane-2,10-dione;thiocyanic acid.
Chemical Property Profile of Erythromycin Thiocyanate
Property Insights of Erythromycin Thiocyanate
The XLogP value of 2.18 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Erythromycin Thiocyanate. The TPSA of 219.0 Ų indicates high polarity, suggesting Erythromycin Thiocyanate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Erythromycin Thiocyanate has 6 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 Erythromycin Thiocyanate?
The CAS number of Erythromycin Thiocyanate is 7704-67-8.
What is the molecular formula of Erythromycin Thiocyanate?
The molecular formula of Erythromycin Thiocyanate is C38H68N2O13S.
What is the molecular weight of Erythromycin Thiocyanate?
The molecular weight of Erythromycin Thiocyanate is 792.44 g/mol.
Where can I buy Erythromycin Thiocyanate?
You can request a quote for Erythromycin Thiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Erythromycin Thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for Erythromycin Thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.