Valnemulin Hydrochloride
econor · Etodoiac · VALNEMULIN HCL · ValneMulin hyd · UNII-W1GDP58BNQ · VALNEMULIN HYDROCH · Valnemulin Hydrochlorid · Vonimorin hydrochloride

Identifiers & Physical Properties
| CAS No. | 133868-46-9 |
|---|---|
| Molecular formula | C31H53ClN2O5S |
| Average molar mass | 601.3 g/mol |
| Monoisotopic mass | 600.33637148 g/mol |
| SMILES | C=C[C@]1(C)C[C@@H](OC(=O)CSC(C)(C)CNC(=O)[C@H](N)C(C)C)[C@]2(C)[C@H](C)CC[C@]3(CCC(=O)[C@H]32)[C@@H](C)[C@@H]1O.Cl |
| InChIKey | MFBPRQKHDIVLOJ-AFFLPQGKSA-N |
| PubChem CID | 60195218 |
| ChEMBL | CHEMBL4591422 |
| EC No. | 685-606-9 |
| DTXSID | DTXSID30158407 |
Chemical & Physical Properties
| Topological polar surface area | 144 |
|---|---|
| Hydrogen bond donors | 4 |
| Hydrogen bond acceptors | 7 |
| Rotatable bonds | 10 |
| Heavy atoms | 40 |
| Formal charge | 0 |
| Complexity | 969 |
| Melting point | 140-143C |
| Storage conditions | Inert atmosphere,Store in freezer, under -20°C |
| Solubility | DMSO (Slightly), Ethanol (Slightly), Methanol (Slightly) |
| Physical state | Solid |
| Color | White to Off-White |
| Merck | 14,9911 |
| InChIKey | MFBPRQKHDIVLOJ-AFFLPQGKSA-N |
| SMILES | C[C@H]1[C@@H]([C@](C[C@@H](OC(=O)CSC(C)(C)CNC(=O)[C@H](N)C(C)C)C2([C@H](C)CCC31CCC(=O)[C@]32[H])C)(C)C=C)O.Cl |&1:1,2,3,5,18,24,33,r| |
| FDA UNII | W1GDP58BNQ |
| UNSPSC Code | 51101500 |
| NACRES | NA.21 |
| GHS pictogram | GHS07,GHS09 |
| Signal word | Warning |
| GHS hazard statements | H410-H319-H302-H400-H335 |
| GHS precautionary statements | P264-P270-P301+P312-P330-P501-P273-P391-P501-P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P |
| Water hazard class (WGK) | 3 |
| Customs code | 2941.90.5000 |
| Storage class | 11 - Combustible Solids |
| Hazard class | Acute Tox. 4 Oral |
Safety & Regulations
| GHS classification | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P304+P340, P305+P351+P338, P319, P330, P337+P317, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 6 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
| Water hazard class (WGK) | 3 |
| Customs code | 2941.90.5000 |
| Signal word | Warning |
| GHS pictogram | GHS07,GHS09 |
| Storage class | 11 - Combustible Solids |
| GHS hazard statements | H410-H319-H302-H400-H335 |
| Hazard class | Acute Tox. 4 Oral |
| GHS precautionary statements | P264-P270-P301+P312-P330-P501-P273-P391-P501-P273-P391-P501-P264-P280-P305+P351+P338-P337+P313P |
Applications & Uses
Uses
Hydrochloride salt Valnemulin, semisynthetic antibiotic; derivative of pleuromutilin. Antibacterial.
Uses
Valnemulin hydrochloride is the salt prepared from valnemulin taking advantage of the basic amino group which protonates and readily forms the salt in hydrochloric acid solutions. The hydrochloride is the preferred formulation for pharmaceutical applications. Valnemulin is a broad spectrum antibiotic used to control gastrointestinal infections in animals, and shows no cross resistance to other antibiotic classes. Like all the pleuromutilins, valnemulin inhibits protein synthesis by binding to domain V of 23S RNA.
Uses
Valnemulin Hydrochloride is a semisynthetic antibiotic; derivative of pleuromutilin. Antibacterial.