(3S)-3-(Octanoyloxy)-4-(Trimethylammonio)Butanoate
[CAS# 25243-95-2]

Identification

• Name: (3S)-3-(Octanoyloxy)-4-(Trimethylammonio)Butanoate
• Synonyms: (3S)-3-octanoyloxy-4-(trimethylammonio)butanoate; (S)-octanoylcarnitine; L-octanoyl-L-carnitine
• Molecular Formula: C₁₅H₂₉NO₄
• Molecular Weight: 287.40
• CAS Registry Number: 25243-95-2
• SMILES: CCCCCCCC(=O)O[C@@H](CC(=O)[O-])C[N+](C)(C)C
• InChI: 1S/C15H29NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h13H,5-12H2,1-4H3/t13-/m0/s1
• InChIKey: CXTATJFJDMJMIY-ZDUSSCGKSA-N

Properties

• Refractive index: (Cal.)