Isovalerylcarnitine
(3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate
Also Known As: Isovalerylcarnitine|isovaleryl-l-carnitine|3-Methylbutyrylcarnitine|Isovaleryl L-carnitine|C5IsovalerylL-Carnitine|O-Isovaleryl-L-carnitine|ISOVALEROYL CARNITINE|Isovalerylcarnitine (Standard)|KST-1A4178|O-3-methylbutanoyl-(R)-carnitine|ST-743|AC-8957|AN-7520|HY-113221R|(R)-3-((3-METHYLBUTANOYL)OXY)-4-(TRIMETHYLAMMONIO)BUTANOATE|(3R)-3-[(3-methylbutanoyl)oxy]-4-(trimethylazaniumyl)butanoate|Isovaleryl-L-carnitine, >=97.0% (TLC)|(3r)-3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate|(3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate|I14-11394|3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate
| Molecular Formula | C12H23NO4 |
|---|---|
| Molecular Weight | 245.1627 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 245.1627 |
| Monoisotopic Mass | 245.1627 |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 35841-67-9 |
|---|---|
| SMILES | CC(C)CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C |
| InChIKey | IGQBPDJNUXPEMT-SNVBAGLBSA-N |
Product Overview
Isovalerylcarnitine (CAS 35841-67-9), with molecular formula C12H23NO4 and molecular weight 245.1627 g/mol. IUPAC: (3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate.
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