HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
(±)-(3-Carboxy-2-hydroxypropyl)trimethylammoniumhydroxid
Cardiogen · Carrier · Cardiogen peptide · Carnum · Miocor · C00487 · Novaine · Excitine
Identifikatoren & physikalische Daten
| CAS No. | 406-76-8 |
|---|---|
| Summenformel | C7H16NO3+ |
| Durchschnittliche Molmasse | 162,21 g/mol |
| Monoisotopische Masse | 162,11301837 g/mol |
| SMILES | C[N+](C)(C)CC(O)CC(=O)O |
| InChIKey | PHIQHXFUZVPYII-UHFFFAOYSA-O |
| PubChem CID | 85 |
| ChEMBL | CHEMBL1620698 |
| ChEBI | CHEBI:3424 |
| Lokaler Name | (±)-(3-Carboxy-2-hydroxypropyl)trimethylammoniumhydroxid |
Chemische & physikalische Eigenschaften
| XLogP | -0,8 |
|---|---|
| Polarare Oberfläche (TPSA) | 57,5 |
| H-Brücken-Donoren | 2 |
| H-Brücken-Akzeptoren | 3 |
| Frei drehbare Bindungen | 4 |
| Schwere Atome | 11 |
| Formalladung | 1 |
| Komplexität | 139 |
| Arzneimittel | Pharmaceuticals |
| Collision Cross Section | 132.9 Ų [M+H]+ |
| Schmelzpunkt | 197-198 °C (decomp) |
| Lagerbedingungen | Store at -20°C |
| Löslichkeit | Soluble in DMSO |
| InChI | InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3 |
| InChIKey | PHIQHXFUZVPYII-UHFFFAOYSA-N |
| SMILES | C(C(O)CC([O-])=O)[N+](C)(C)C |
Sicherheit & Vorschriften
| Regulatorische Informationen | 1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, inner salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right. |
|---|---|
| Alarmwort | Warnung |
| Gefahrenhinweise | Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302 |
Anwendungen & Verwendung
Verwenden
DL-Carnitine is a Chloride salt free form of D,L-Carnitine Chloride (C184100). Carnitine is a vitamin, essential cofactor of fatty acid metabolism. It is required for the transport of fatty acids through the inner mitochondrial membrane. Synthesized primarily in the liver and kidney; highest concentrations found in heart and skeletal muscle. Dietary sources include red meat, dairy products, beans, avocado.